2-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-8-phenylquinoline-4-carboxamide
Chemical Structure Depiction of
2-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-8-phenylquinoline-4-carboxamide
2-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-8-phenylquinoline-4-carboxamide
Compound characteristics
| Compound ID: | F941-0204 |
| Compound Name: | 2-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-8-phenylquinoline-4-carboxamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C25 H22 N2 O S |
| Smiles: | Cc1cc(C(NCc2ccc(cc2)SC)=O)c2cccc(c3ccccc3)c2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8644 |
| logD: | 5.8639 |
| logSw: | -5.7778 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.288 |
| InChI Key: | RPTRWTZNWMKDAX-UHFFFAOYSA-N |