[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl][3-(4-chlorophenyl)-1H-pyrazol-5-yl]methanone
Chemical Structure Depiction of
[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl][3-(4-chlorophenyl)-1H-pyrazol-5-yl]methanone
[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl][3-(4-chlorophenyl)-1H-pyrazol-5-yl]methanone
Compound characteristics
| Compound ID: | E687-0375 |
| Compound Name: | [4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl][3-(4-chlorophenyl)-1H-pyrazol-5-yl]methanone |
| Molecular Weight: | 515.83 |
| Molecular Formula: | C18 H16 Br Cl N4 O3 S2 |
| Smiles: | C1CN(CCN1C(c1cc(c2ccc(cc2)[Cl])n[nH]1)=O)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2625 |
| logD: | 4.2619 |
| logSw: | -4.547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.914 |
| InChI Key: | HTKKMSRVPXDMCN-UHFFFAOYSA-N |