4-bromo-2-({4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazin-1-yl}methyl)phenol
Chemical Structure Depiction of
4-bromo-2-({4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazin-1-yl}methyl)phenol
4-bromo-2-({4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazin-1-yl}methyl)phenol
Compound characteristics
Compound ID: | P867-0190 |
Compound Name: | 4-bromo-2-({4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazin-1-yl}methyl)phenol |
Molecular Weight: | 414.3 |
Molecular Formula: | C19 H20 Br N5 O |
Smiles: | C1CN(CCN1Cc1cc(ccc1O)[Br])c1cc(c2ccncc2)n[nH]1 |
Stereo: | ACHIRAL |
logP: | 3.0194 |
logD: | 2.8716 |
logSw: | -2.7071 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.161 |
InChI Key: | JPDUQYQEEZYYGD-UHFFFAOYSA-N |