3-[3-(4-acetylpiperazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-[3-(4-acetylpiperazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
3-[3-(4-acetylpiperazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D627-0017 |
| Compound Name: | 3-[3-(4-acetylpiperazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazol-1-yl]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C18 H22 N4 O4 S2 |
| Smiles: | CC(N1CCN(CC1)C(c1cc(c2cccs2)n(C2CCS(C2)(=O)=O)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3298 |
| logD: | 0.3298 |
| logSw: | -1.9972 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.194 |
| InChI Key: | APFAUQMQHKKVMO-CQSZACIVSA-N |