methyl [6-{[(3-bromophenyl)methyl]sulfamoyl}-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
Chemical Structure Depiction of
methyl [6-{[(3-bromophenyl)methyl]sulfamoyl}-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
methyl [6-{[(3-bromophenyl)methyl]sulfamoyl}-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
Compound characteristics
| Compound ID: | F064-0342 |
| Compound Name: | methyl [6-{[(3-bromophenyl)methyl]sulfamoyl}-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate |
| Molecular Weight: | 455.28 |
| Molecular Formula: | C17 H15 Br N2 O6 S |
| Smiles: | COC(CN1C(=O)Oc2cc(ccc12)S(NCc1cccc(c1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.585 |
| logD: | 2.5846 |
| logSw: | -3.1025 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.676 |
| InChI Key: | ZNIHQDFSKKHLPH-UHFFFAOYSA-N |