[4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl][3-(thiophen-2-yl)-1H-pyrazol-5-yl]methanone
Chemical Structure Depiction of
[4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl][3-(thiophen-2-yl)-1H-pyrazol-5-yl]methanone
[4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl][3-(thiophen-2-yl)-1H-pyrazol-5-yl]methanone
Compound characteristics
| Compound ID: | E687-0059 |
| Compound Name: | [4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl][3-(thiophen-2-yl)-1H-pyrazol-5-yl]methanone |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C22 H26 N4 O3 S2 |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCN(CC1)C(c1cc(c2cccs2)n[nH]1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5975 |
| logD: | 4.5973 |
| logSw: | -4.2658 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.914 |
| InChI Key: | XXIPGIUMVSQLNG-UHFFFAOYSA-N |