[3-(4-chlorophenyl)-1H-pyrazol-5-yl][4-(4-fluoro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[3-(4-chlorophenyl)-1H-pyrazol-5-yl][4-(4-fluoro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]methanone
[3-(4-chlorophenyl)-1H-pyrazol-5-yl][4-(4-fluoro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | E687-0369 |
| Compound Name: | [3-(4-chlorophenyl)-1H-pyrazol-5-yl][4-(4-fluoro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]methanone |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C21 H20 Cl F N4 O3 S |
| Smiles: | Cc1cc(ccc1F)S(N1CCN(CC1)C(c1cc(c2ccc(cc2)[Cl])n[nH]1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2292 |
| logD: | 4.2287 |
| logSw: | -4.5311 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.895 |
| InChI Key: | PKRURAKMRHBHRR-UHFFFAOYSA-N |