2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | Y511-9342 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one |
| Molecular Weight: | 283.35 |
| Molecular Formula: | C16 H13 N O2 S |
| Smiles: | Cc1ccc(cc1)C(CSc1nc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.216 |
| logD: | 4.216 |
| logSw: | -4.332 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.88 |
| InChI Key: | GOXYRPULFOIYSG-UHFFFAOYSA-N |