2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-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)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
Compound ID: | 8012-9560 |
Compound Name: | 2-amino-4-(2,3-dichlorophenyl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
Molecular Weight: | 446.28 |
Molecular Formula: | C22 H15 Cl2 F2 N3 O |
Smiles: | C1CC2=C(C(C(C#N)=C(N)N2c2c(cccc2F)F)c2cccc(c2[Cl])[Cl])C(C1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8266 |
logD: | 4.8266 |
logSw: | -4.7948 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.775 |
InChI Key: | SUIHBOMXPJPOLU-GOSISDBHSA-N |