2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8015-2065 |
| Compound Name: | 2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 478.68 |
| Molecular Formula: | C26 H30 N4 O S2 |
| Smiles: | CCc1cc(C2C(C#N)=C(N)N(C3CC(CC(C2=3)=O)c2ccccc2)N(C)C)c(SCC)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2511 |
| logD: | 5.2511 |
| logSw: | -5.0004 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.659 |
| InChI Key: | VBWITZSAPVJGSN-UHFFFAOYSA-N |