2-[(4-chlorophenyl)sulfanyl]-N-(2-oxo-2H-1-benzopyran-4-yl)acetamide
Chemical Structure Depiction of
2-[(4-chlorophenyl)sulfanyl]-N-(2-oxo-2H-1-benzopyran-4-yl)acetamide
2-[(4-chlorophenyl)sulfanyl]-N-(2-oxo-2H-1-benzopyran-4-yl)acetamide
Compound characteristics
| Compound ID: | IB07-1357 |
| Compound Name: | 2-[(4-chlorophenyl)sulfanyl]-N-(2-oxo-2H-1-benzopyran-4-yl)acetamide |
| Molecular Weight: | 345.8 |
| Molecular Formula: | C17 H12 Cl N O3 S |
| Smiles: | C(C(NC1=CC(=O)Oc2ccccc12)=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.51 |
| logD: | 2.42 |
| logSw: | -4.34 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 133.96 |
| InChI Key: | PAFYKSPMZAKJJR-UHFFFAOYSA-N |