methyl {6-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Chemical Structure Depiction of
methyl {6-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
methyl {6-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Compound characteristics
| Compound ID: | F064-0172 |
| Compound Name: | methyl {6-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate |
| Molecular Weight: | 461.49 |
| Molecular Formula: | C21 H23 N3 O7 S |
| Smiles: | COC(CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1468 |
| logD: | 2.1467 |
| logSw: | -3.0141 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.433 |
| InChI Key: | MRFPQZGOHAEADX-UHFFFAOYSA-N |