4-[5-amino-4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
Chemical Structure Depiction of
4-[5-amino-4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
4-[5-amino-4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | 8018-7896 |
| Compound Name: | 4-[5-amino-4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid |
| Molecular Weight: | 313.74 |
| Molecular Formula: | C16 H12 Cl N3 O2 |
| Smiles: | c1cc(ccc1C(O)=O)n1c(c(cn1)c1ccc(cc1)[Cl])N |
| Stereo: | ACHIRAL |
| logP: | 3.9952 |
| logD: | 1.109 |
| logSw: | -4.5324 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.691 |
| InChI Key: | AXBKSXNMJJDWCB-UHFFFAOYSA-N |