2,7,7-trimethyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
2,7,7-trimethyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
2,7,7-trimethyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 4306-1067 |
| Compound Name: | 2,7,7-trimethyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-N-(4-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 467.65 |
| Molecular Formula: | C25 H29 N3 O2 S2 |
| Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1cc(C)sc1SC)C(Nc1cc(C)ccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4119 |
| logD: | 3.3417 |
| logSw: | -5.269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.646 |
| InChI Key: | LSTOTWVPWBNINQ-NRFANRHFSA-N |