1-(methanesulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
Chemical Structure Depiction of
1-(methanesulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
1-(methanesulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
Compound characteristics
| Compound ID: | D256-0777 |
| Compound Name: | 1-(methanesulfonyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide |
| Molecular Weight: | 376.49 |
| Molecular Formula: | C18 H20 N2 O3 S2 |
| Smiles: | CSc1cccc(c1)NC(c1ccc2c(CCCN2S(C)(=O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7479 |
| logD: | 2.7474 |
| logSw: | -3.5648 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.246 |
| InChI Key: | NRXQTQSGUSFHMN-UHFFFAOYSA-N |