N-[(3-methoxyphenyl)methyl]-2-{[4-(propan-2-yl)phenyl]sulfanyl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-{[4-(propan-2-yl)phenyl]sulfanyl}quinoline-4-carboxamide
N-[(3-methoxyphenyl)methyl]-2-{[4-(propan-2-yl)phenyl]sulfanyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-9615 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-{[4-(propan-2-yl)phenyl]sulfanyl}quinoline-4-carboxamide |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C27 H26 N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)Sc1cc(C(NCc2cccc(c2)OC)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3043 |
| logD: | 7.3043 |
| logSw: | -5.9273 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.616 |
| InChI Key: | ONXVGRJMWQQGHA-UHFFFAOYSA-N |