2-amino-1-(2,6-difluorophenyl)-4-(3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(2,6-difluorophenyl)-4-(3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(2,6-difluorophenyl)-4-(3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-9547 |
| Compound Name: | 2-amino-1-(2,6-difluorophenyl)-4-(3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C23 H19 F2 N3 O2 |
| Smiles: | COc1cccc(c1)C1C(C#N)=C(N)N(C2CCCC(C1=2)=O)c1c(cccc1F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4586 |
| logD: | 3.4586 |
| logSw: | -3.9901 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.319 |
| InChI Key: | PQBDWJNRXFZZOM-FQEVSTJZSA-N |