ethyl 3-{2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-3(2H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-3(2H)-yl]acetamido}benzoate
ethyl 3-{2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-3(2H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | K906-2914 |
| Compound Name: | ethyl 3-{2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-3(2H)-yl]acetamido}benzoate |
| Molecular Weight: | 473.5 |
| Molecular Formula: | C22 H23 N3 O7 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(=O)Oc2cc(ccc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2817 |
| logD: | 3.2817 |
| logSw: | -3.8078 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.047 |
| InChI Key: | HMMSADJKGCPHEX-UHFFFAOYSA-N |