{4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | E687-0562 |
| Compound Name: | {4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 445.34 |
| Molecular Formula: | C19 H17 Br N4 O2 S |
| Smiles: | C1CN(CCN1C(c1cc(c2ccc(cc2)[Br])n[nH]1)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8379 |
| logD: | 3.8374 |
| logSw: | -4.0634 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.851 |
| InChI Key: | RPXJCVRZXCDYQJ-UHFFFAOYSA-N |