2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-9561 |
| Compound Name: | 2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 474.34 |
| Molecular Formula: | C24 H19 Cl2 F2 N3 O |
| Smiles: | CC1(C)CC2=C(C(C(C#N)=C(N)N2c2c(cccc2F)F)c2cccc(c2[Cl])[Cl])C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4516 |
| logD: | 5.4516 |
| logSw: | -5.6877 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.775 |
| InChI Key: | PBGBAZHXZPLTLH-LJQANCHMSA-N |