methyl {6-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Chemical Structure Depiction of
methyl {6-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
methyl {6-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Compound characteristics
| Compound ID: | F064-0118 |
| Compound Name: | methyl {6-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate |
| Molecular Weight: | 473.5 |
| Molecular Formula: | C22 H23 N3 O7 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1ccc2c(c1)OC(N2CC(=O)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7065 |
| logD: | 1.7065 |
| logSw: | -2.5989 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 92.715 |
| InChI Key: | YTHSUCFMNDZUJD-UHFFFAOYSA-N |