2-amino-1-(dimethylamino)-7,7-dimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(dimethylamino)-7,7-dimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(dimethylamino)-7,7-dimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8015-3781 |
| Compound Name: | 2-amino-1-(dimethylamino)-7,7-dimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 406.55 |
| Molecular Formula: | C23 H26 N4 O S |
| Smiles: | Cc1c2ccccc2sc1C1C(C#N)=C(N)N(C2CC(C)(C)CC(C1=2)=O)N(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5665 |
| logD: | 3.5665 |
| logSw: | -3.8676 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.659 |
| InChI Key: | FMPSJNBZRBONNA-LJQANCHMSA-N |