methyl 4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)amino]benzoate
methyl 4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | C608-0047 |
| Compound Name: | methyl 4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)amino]benzoate |
| Molecular Weight: | 362.36 |
| Molecular Formula: | C16 H14 N2 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(Nc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2944 |
| logD: | 2.2607 |
| logSw: | -3.0241 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.928 |
| InChI Key: | IWZIWPPYILHPLE-UHFFFAOYSA-N |