5-({1-[(2,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-({1-[(2,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
5-({1-[(2,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6053 |
| Compound Name: | 5-({1-[(2,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 422.27 |
| Molecular Formula: | C18 H17 Cl2 N5 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2[Cl])[Cl])n1)NC(c1c(cnn1C)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3917 |
| logD: | -1.7971 |
| logSw: | -3.2133 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.14 |
| InChI Key: | HIROTBZAWLCVQK-UHFFFAOYSA-N |