3-[3-(4-acetylpiperazine-1-carbonyl)-5-(4-methoxyphenyl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-[3-(4-acetylpiperazine-1-carbonyl)-5-(4-methoxyphenyl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
3-[3-(4-acetylpiperazine-1-carbonyl)-5-(4-methoxyphenyl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D473-1964 |
| Compound Name: | 3-[3-(4-acetylpiperazine-1-carbonyl)-5-(4-methoxyphenyl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C21 H26 N4 O5 S |
| Smiles: | CC(N1CCN(CC1)C(c1cc(c2ccc(cc2)OC)n(C2CCS(C2)(=O)=O)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6482 |
| logD: | 0.6482 |
| logSw: | -2.1343 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.719 |
| InChI Key: | INEXIOGPKINKMF-QGZVFWFLSA-N |