2-methyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
2-methyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
2-methyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 4306-1023 |
| Compound Name: | 2-methyl-4-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 501.67 |
| Molecular Formula: | C28 H27 N3 O2 S2 |
| Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2)N1)c1cc(C)sc1SC)C(Nc1ccccn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4176 |
| logD: | 4.1556 |
| logSw: | -5.5842 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.374 |
| InChI Key: | DJEOUOJQARWCCR-UHFFFAOYSA-N |