C17h19N3O6 TRANSMIDE, IS -OXO- α - [(phenylMethyl) AMINO] - (ACI)
Helu helu helu helu
944268-75-1
ʻO nā waiwai pilikino | Waiwai | Kauoha |
Kaupaona molebular | 361.35 | - |
Density (wānana) | 1.459 ± 0.066 G / cm3 | Temp: 20 ° C; E kaomi: 760 Torr |
PKA (wānana) | 8.27 ± 0.10 | Nui loa acidic temp: 25 ° C |
Nā'ōmole cannical
O = C1NC (= o) n (c = c1c (= o) cc2) cc2) cc2
Nā meaʻakaʻakaʻo Isomeric
O = c1n ([c @@ @ h __ (c (c (c
Iachi
Inchi = 1s / c17h19n3o6-8-9-1-0-10-,5-5-10-3-5-10-,9-,5-,5-,5-10-9-,5-0-5-14 H2, (H, 18,23) (H, 19,24,25 / L12- Akā 14 + SM0 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1 / S1
Inchi kī
VBRYAGCEXXCHM-BFHYXJOUSA-n
3ʻO nā inoa'ē aʻe no kēia waiwai
α -oxo-α - [((phenylmithyl) amino] mysmidine (Aci); (Bndu); 7: PN: WON: WO2020081510 squID: 7
Loaʻa nā waiwai
Loea
Kekau
Huakai
Lipinski
Pili pū ka piliʻana
Waiwai | Waiwai | Kauoha | Kumu |
Pūnaehana Pūnaewele | 1.0 | pH 1; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | PH 2; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | pH 3; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | PH 4; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | pH 5; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | ph 6; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | ph 7; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | pH 8; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | pH 9; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 1.0 | PH 10; Temp: 25 ° C | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Waiwai waiwai waiwai kumu |
Ko- 18.3 P 2; Temp: 25 ° C (1) ACD |
Kocs 18.3 P 2H 2; Temp: 25 ° C (1) ACD |
Koc 18.3 pH 3; Temp: 25 ° C (1) ACD |
Koc 18.3 P 2; Temp: 25 ° C (1) ACD |
Koc 18.3 ph 5; Temp: 25 ° C (1) ACD |
Kocs 18.1 ph 6; Temp: 25 ° C (1) ACD |
Koc 16.4 pH 7; Temp: 25 ° C (1) ACD |
Koc Wac Wac Wac 856 Prop 8; Temp: 25 ° C (1) ACD |
KoC 1.62 p p pp 9; Temp: 25 ° C (1) ACD |
Koc 1.0 PH 10; Temp: 25 ° C (1) ACD |
logd -0.21 ph 1; Temp: 25 ° C (1) ACD |
logd -0.21 ph 2; Temp: 25 ° C (1) ACD |
Waiwai | Waiwai | Kauoha | Kumu |
Kākau | -0.21 | pH 3; Temp: 25 ° C | (1) acd |
Kākau | -0.21 | PH 4; Temp: 25 ° C | (1) acd |
Kākau | -0.21 | pH 5; Temp: 25 ° C | (1) acd |
Kākau | -0.22 | ph 6; Temp: 25 ° C | (1) acd |
Kākau | -0.26 | ph 7; Temp: 25 ° C | (1) acd |
Kākau | -0.54 | pH 8; Temp: 25 ° C | (1) acd |
Kākau | -1.26 | pH 9; Temp: 25 ° C | (1) acd |
Kākau | -1.95 | PH 10; Temp: 25 ° C | (1) acd |
LOGP | -0.212 ± 0.585 | Temp: 25 ° C | (1) acd |
ʻO ka solubilitic intrinsic | 0.13 G / l | Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.13 G / l | pH 1; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.13 G / l | PH 2; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.13 G / l | pH 3; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.13 G / l | PH 4; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.13 G / l | pH 5; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.14 g / l | ph 6; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.15 g / l | ph 7; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.29 g / l | pH 8; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.5 g / l | pH 9; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 7.2 g / l | PH 10; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.14 g / l | Whraffeered wai ph 168; Temp: 25 ° C | (1) acd |
Molala intrinsic repubility | 3.7 x 10-4 mol / l | Temp: 25 ° C | (1) acd |
Mlagerliility | 3.7 x 10-4 mol / l | pH 1; Temp: 25 ° C | (1) acd |
Mlagerliility | 3.7 x 10-4 mol / l | PH 2; Temp: 25 ° C | (1) acd |
Mlagerliility | 3.7 x 10-4 mol / l | pH 3; Temp: 25 ° C | (1) acd |
Mlagerliility | 3.7 x 10-4 mol / l | PH 4; Temp: 25 ° C | (1) acd |
Mlagerliility | 3.7 x 10-4 mol / l | pH 5; Temp: 25 ° C | (1) acd |
Mlagerliility | 3.8 x 10-4 mol / l | ph 6; Temp: 25 ° C | (1) acd |
Mlagerliility | 4.2 x 10-4 mol / l | ph 7; Temp: 25 ° C | (1) acd |
Mlagerliility | 8.0 x 10-4 mol / l | pH 8; Temp: 25 ° C | (1) acd |
Mlagerliility | 4.2 x 10-3 mol / l | pH 9; Temp: 25 ° C | (1) acd |
Mlagerliility | 0,020 mol / l | PH 10; Temp: 25 ° C | (1) acd |
Waiwai | Waiwai | Kauoha | Kumu |
Mlagerliility | 3.8 x 10-4 mol / l | Whraffeered wai ph 168; Temp: 25 ° C | (1) acd |
Kaupaona molebular | 361.35 | ||
pka | 8.27 ± 0.10 | Nui loa acidic temp: 25 ° C | (1) acd |
pka | -1.66 ± 0.20 | ʻO ka hapa nui o ka temp: 25 ° C | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Waiwai | Waiwai | Kauoha | Kumu |
Huakai | 1.459 ± 0.066 G / cm3 | Temp: 20 ° C; E kaomi: 760 Torr | (1) acd |
Mlar lang | 247.5 ± 3.0 cm3 / mol | Temp: 20 ° C; E kaomi: 760 Torr | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Waiwai | Waiwai | Kauoha | Kumu |
Nā mea paʻa paʻa | 7 | (1) acd | |
Hcceptors | 9 | (1) acd | |
H donors | 4 | (1) acd | |
H hāʻawi /ʻaeʻia ka loaʻa kālā | 13 | (1) acd | |
LOGP | -0.212 ± 0.585 | Temp: 25 ° C | (1) acd |
Kaupaona molebular | 361.35 |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Waiwai | Waiwai | Kumu kumu |
Wahi wahi papa | 128 a2 | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Specpe i Loa
1 h nmr
13 c nmr