methyl {6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Chemical Structure Depiction of
methyl {6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
methyl {6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Compound characteristics
| Compound ID: | F064-0082 |
| Compound Name: | methyl {6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)S(c1ccc2c(c1)OC(N2CC(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1664 |
| logD: | 3.1664 |
| logSw: | -3.5806 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.588 |
| InChI Key: | SJKXXIBWRXFWJF-UHFFFAOYSA-N |