2-amino-4-(2,5-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,5-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,5-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-4557 |
| Compound Name: | 2-amino-4-(2,5-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C24 H22 F N3 O |
| Smiles: | Cc1ccc(C)c(c1)C1C(C#N)=C(N)N(C2CCCC(C1=2)=O)c1cccc(c1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2583 |
| logD: | 4.2583 |
| logSw: | -4.4713 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.377 |
| InChI Key: | KGDZOSIQYBKPNP-QFIPXVFZSA-N |