5-[(4-bromophenyl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[(4-bromophenyl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylic acid
5-[(4-bromophenyl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y502-2860 |
| Compound Name: | 5-[(4-bromophenyl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 324.13 |
| Molecular Formula: | C12 H10 Br N3 O3 |
| Smiles: | Cn1c(cc(C(O)=O)n1)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7819 |
| logD: | -1.5838 |
| logSw: | -2.3219 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.254 |
| InChI Key: | YCNVOICQRDNJQP-UHFFFAOYSA-N |