2-amino-4-(5-tert-butylthiophen-2-yl)-7,7-dimethyl-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-tert-butylthiophen-2-yl)-7,7-dimethyl-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(5-tert-butylthiophen-2-yl)-7,7-dimethyl-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8006-6750 |
| Compound Name: | 2-amino-4-(5-tert-butylthiophen-2-yl)-7,7-dimethyl-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 445.63 |
| Molecular Formula: | C27 H31 N3 O S |
| Smiles: | Cc1ccc(cc1)N1C2CC(C)(C)CC(C=2C(C(C#N)=C1N)c1ccc(C(C)(C)C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7052 |
| logD: | 5.7052 |
| logSw: | -5.4225 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.395 |
| InChI Key: | YAWWKZNIYQXOQT-QHCPKHFHSA-N |