2-amino-4-(2,4-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,4-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,4-dimethylphenyl)-1-(3-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-4563 |
| Compound Name: | 2-amino-4-(2,4-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(C2C(C#N)=C(N)N(C3CCCC(C2=3)=O)c2cccc(c2)F)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3903 |
| logD: | 4.3903 |
| logSw: | -4.5135 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.377 |
| InChI Key: | MRDWJRSMQSAVKY-QFIPXVFZSA-N |