butyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
butyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
butyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8012-7344 |
| Compound Name: | butyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C20 H20 N2 O4 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(CSc1nc2ccccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2513 |
| logD: | 5.2512 |
| logSw: | -5.0679 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.827 |
| InChI Key: | NFOHHKRQFUXXCS-UHFFFAOYSA-N |