2-amino-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
Compound ID: | 8006-8012 |
Compound Name: | 2-amino-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
Molecular Weight: | 389.52 |
Molecular Formula: | C23 H23 N3 O S |
Smiles: | Cc1cccc(c1)N1C2CC(C)(C)CC(C=2C(C(C#N)=C1N)c1cccs1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8956 |
logD: | 3.8956 |
logSw: | -4.1331 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.395 |
InChI Key: | CWYURRLGGJZPKQ-FQEVSTJZSA-N |