5-[(5-chloro-2-methoxyphenyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-[(5-chloro-2-methoxyphenyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
5-[(5-chloro-2-methoxyphenyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6175 |
| Compound Name: | 5-[(5-chloro-2-methoxyphenyl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 309.71 |
| Molecular Formula: | C13 H12 Cl N3 O4 |
| Smiles: | Cn1c(C(Nc2cc(ccc2OC)[Cl])=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9474 |
| logD: | -2.2414 |
| logSw: | -2.9386 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.186 |
| InChI Key: | IPNLRJDVXMFAPS-UHFFFAOYSA-N |