2-amino-1-(2,6-difluorophenyl)-4-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(2,6-difluorophenyl)-4-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(2,6-difluorophenyl)-4-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-9553 |
| Compound Name: | 2-amino-1-(2,6-difluorophenyl)-4-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 395.38 |
| Molecular Formula: | C22 H16 F3 N3 O |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)N2c2c(cccc2F)F)c2ccc(cc2)F)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4752 |
| logD: | 3.4752 |
| logSw: | -3.8672 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.775 |
| InChI Key: | AQWHYJLLUZFKNL-IBGZPJMESA-N |