2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-(4-nitrophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-(4-nitrophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-(4-nitrophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 5066-0358 |
| Compound Name: | 2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-(4-nitrophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C25 H26 N4 O2 |
| Smiles: | Cc1ccc(cc1)C1C2CCC(C)(C)CC=2N(C(=C1C#N)N)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0204 |
| logD: | 5.0204 |
| logSw: | -4.868 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.51 |
| InChI Key: | PNHMHMIDGQSGPQ-QHCPKHFHSA-N |