1-(4-bromophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-bromophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
1-(4-bromophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y041-1107 |
| Compound Name: | 1-(4-bromophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 332.15 |
| Molecular Formula: | C14 H10 Br N3 O2 |
| Smiles: | c1ccn(c1)c1c(cnn1c1ccc(cc1)[Br])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1009 |
| logD: | -0.9818 |
| logSw: | -4.2234 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.503 |
| InChI Key: | XJBNVDSPVQJIJA-UHFFFAOYSA-N |