2-amino-1-(3-methyl-4-phenyl-1H-pyrazol-5-yl)-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(3-methyl-4-phenyl-1H-pyrazol-5-yl)-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(3-methyl-4-phenyl-1H-pyrazol-5-yl)-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y020-1691 |
| Compound Name: | 2-amino-1-(3-methyl-4-phenyl-1H-pyrazol-5-yl)-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C26 H23 N5 O |
| Smiles: | Cc1c(c2ccccc2)c([nH]n1)N1C2CCCC(C=2C(C(C#N)=C1N)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.603 |
| logD: | 3.603 |
| logSw: | -3.9679 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.377 |
| InChI Key: | BGUWQTPVSCCPGJ-HSZRJFAPSA-N |