ethyl [6-(4-benzylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
Chemical Structure Depiction of
ethyl [6-(4-benzylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
ethyl [6-(4-benzylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate
Compound characteristics
| Compound ID: | C602-0144 |
| Compound Name: | ethyl [6-(4-benzylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | CCOC(CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2586 |
| logD: | 2.2518 |
| logSw: | -2.8752 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 78.749 |
| InChI Key: | GZPLIMBCHUXBKH-UHFFFAOYSA-N |