2-(4-bromophenyl)-1-{4-[5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-bromophenyl)-1-{4-[5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
2-(4-bromophenyl)-1-{4-[5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G639-3652 |
| Compound Name: | 2-(4-bromophenyl)-1-{4-[5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 454.32 |
| Molecular Formula: | C21 H20 Br N5 O2 |
| Smiles: | C(C(N1CCN(CC1)C(c1cc(c2cccnc2)[nH]n1)=O)=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.4769 |
| logD: | 2.4768 |
| logSw: | -2.4507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.823 |
| InChI Key: | ITSCVZFYXIUOEA-UHFFFAOYSA-N |