methyl 2-{2-[(7-chloroquinolin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[(7-chloroquinolin-4-yl)sulfanyl]acetamido}benzoate
methyl 2-{2-[(7-chloroquinolin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8016-3809 |
| Compound Name: | methyl 2-{2-[(7-chloroquinolin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 386.85 |
| Molecular Formula: | C19 H15 Cl N2 O3 S |
| Smiles: | COC(c1ccccc1NC(CSc1ccnc2cc(ccc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1326 |
| logD: | 4.1138 |
| logSw: | -4.4555 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.355 |
| InChI Key: | ZCQNQYJKAUBTEW-UHFFFAOYSA-N |