2-amino-4-(2,4-dichlorophenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,4-dichlorophenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,4-dichlorophenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y508-8126 |
| Compound Name: | 2-amino-4-(2,4-dichlorophenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 439.34 |
| Molecular Formula: | C23 H20 Cl2 N4 O |
| Smiles: | CC1(C)CC2=C(C(C(C#N)=C(N)N2c2cccnc2)c2ccc(cc2[Cl])[Cl])C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3516 |
| logD: | 4.3516 |
| logSw: | -4.4413 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.895 |
| InChI Key: | XJIKKRDJZHRXSO-HXUWFJFHSA-N |