L-ornitaninamide, l-vilyl-n5- (aminocarbonyl) -N-
Nga taonga tinana matua | Wāriu | Āhuatanga |
Taumaha Momo | 379.45 | - |
Kohua (tohu) | 715.0 ± 60.0 ° C | Press: 760 Torr |
Te mutunga (tohua) | 1.243 ± 0.06 g / cm3 | TOM: 20 ° C; Press: 760 Torr |
PK (tohua) | 13.75 ± 0.46 | Te nuinga o te Opeware: 25 ° C |
SMILSICAL CLIMS O = C (N) NCCCC (NC (O) C (n) C (C) C (= O) NC1 = CC = C1) Co
He ataata isomeric [c @@ h] (nc (c @ h] (c (c) c) = c (c (nc1 = c1) = o) cccnc (n) = o
Hapani
Inchi = 1S / C18H29N5O4 / C1-11 (C1-11 (2) 15 (26) 17 (26) 27) 27) 22) 22) 22) 22) 22) 22) H2,1-2H3, (H, 22,25) (H, 23,26) (H3,20,21,27) / T14-, 15- / M0 / S1
Inchi Key
Vegttwzuzgzkhy-gjzgruslsa-n
4 etahi atu ingoa mo tenei taonga
L-vilyl-N5- (Aminocarbonyl) -N- [4- (Hydroxymethyl) Phenyl] -l-ornithinamide (aci); 1: PN: WO20230612244 Whārangi: 34 raupapa kereme; Valine-Citrulline-p-Tainobenzylcatebamate; VC-PAB
Nga Taonga e waatea ana |
Pāpori |
Matū |
Tōnu |
Lipinski |
Hanganga |
Thermal |
Pāpori
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te take koiora | 1.0 | Ph 1; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | ph 2; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | wh 3; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | ph 4; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | A 5; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | ph 6; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | A 7; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | A 8; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | A 9; Top: 25 ° C | (1) ACD |
Te take koiora | 1.0 | ph 10; Top: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Matū
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hononga | 1.0 | Ph 1; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | ph 2; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | wh 3; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | ph 4; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | A 5; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | ph 6; Top: 25 ° C | (1) ACD |
Hononga | 1.0 | A 7; Top: 25 ° C | (1) ACD |
Hononga | 6.00 | A 8; Top: 25 ° C | (1) ACD |
Hononga | 13.2 | A 9; Top: 25 ° C | (1) ACD |
Hononga | 15.0 | ph 10; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
arotau | -3.53 | Ph 1; Top: 25 ° C | (1) ACD |
arotau | -3.46 | ph 2; Top: 25 ° C | (1) ACD |
arotau | -3.45 | wh 3; Top: 25 ° C | (1) ACD |
arotau | -3.42 | ph 4; Top: 25 ° C | (1) ACD |
arotau | -3.20 | A 5; Top: 25 ° C | (1) ACD |
arotau | -2.50 | ph 6; Top: 25 ° C | (1) ACD |
arotau | -1.57 | A 7; Top: 25 ° C | (1) ACD |
arotau | -0.76 | A 8; Top: 25 ° C | (1) ACD |
arotau | -0.42 | A 9; Top: 25 ° C | (1) ACD |
arotau | -0.36 | ph 10; Top: 25 ° C | (1) ACD |
arotau | -0.354 ± 0.602 | Top: 25 ° C | (1) ACD |
Ko te whakaraeraetanga o te papatipu | 1.6 g / l | Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1000 g / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1000 g / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1000 g / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1000 g / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1000 g / l | A 5; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 220 g / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 26 g / l | A 7; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 4.2 g / l | A 8; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.9 g / l | A 9; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.6 g / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.6 g / l | Te wai koretake o te waea 9.89; Top: 25 ° C | (1) ACD |
Ko te ngoikoretanga o te kolarsic | 4.2 x 10-3 mol / l | Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.64 mol / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.64 mol / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.64 mol / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.64 mol / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.64 mol / l | A 5; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 0.59 mol / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 0.069 mol / l | A 7; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 0.011 mol / l | A 8; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te whakararatanga a Molar | 4.9 x 10-3 mol / l | A 9; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 4.3 x 10-3 mol / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 4.3 x 10-3 mol / l | Te wai koretake o te waea 9.89; Top: 25 ° C | (1) ACD |
Taumaha Momo | 379.45 | ||
pāt | 13.75 ± 0.46 | Te nuinga o te Opeware: 25 ° C | (1) ACD |
pāt | 8.19 ± 0.33 | Te tino tauira taketake: 25 ° C | (1) ACD |
Te pēhanga umu | 1.86 x 10-21 Torr | Top: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Tōnu
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Tōnu | 1.243 ± 0.06 g / cm3 | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
Rōnga MOAR | 305.2 ± 3.0 cm3 / mol | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Lipinski
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Nga here hurihuri noa | 12 | (1) ACD | |
H whakaae | 9 | (1) ACD | |
Ko nga putea | 8 | (1) ACD | |
H Donor / Whakaaetanga moni | 17 | (1) ACD | |
arotau | -0.354 ± 0.602 | Top: 25 ° C | (1) ACD |
Taumaha Momo | 379.45 |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Hanganga
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te rohe mata o te polar | 160 A2 | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Thermal
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Kohua | 715.0 ± 60.0 ° C | Press: 760 Torr | (1) ACD |
Tuhinga o mua | 109.72 ± 3.0 KJ / Mol | Press: 760 Torr | (1) ACD |
Wāhi uira | 386.2 ± 32.9 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
E waatea ana te Spectra
1h nmr
13c nmr
Tohu pūmanawa | Tauākī mōrearea | Mātāpuna |
H335 | Kia raru ai te manawa manawa | Te Acency Cheropication (ECA) Whakarōpū & Tohu Raarangi - Te Whakaputanga Korero - Te Tauira Tae Atu - ECA) Te Tauira me te Tapanga Tohu |
H319 | Meinga te tino kanohi pouri | Te Acency Cheropication (ECA) Whakarōpū & Tohu Raarangi - Te Whakaputanga Korero - Te Tauira Tae Atu - ECA) Te Tauira me te Tapanga Tohu |
H315 | Meinga te kiri kiri | Te Acency Cheropication (ECA) Whakarōpū & Tohu Raarangi - Te Whakaputanga Korero - Te Tauira Tae Atu - ECA) Te Tauira me te Tapanga Tohu |
H302 | Kino ki te horomia | Te Acency Cheropication (ECA) Whakarōpū & Tohu Raarangi - Te Whakaputanga Korero - Te Tauira Tae Atu - ECA) Te Tauira me te Tapanga Tohu |