5-{[4-(difluoromethoxy)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-{[4-(difluoromethoxy)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
5-{[4-(difluoromethoxy)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-5973 |
| Compound Name: | 5-{[4-(difluoromethoxy)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 311.24 |
| Molecular Formula: | C13 H11 F2 N3 O4 |
| Smiles: | Cn1c(C(Nc2ccc(cc2)OC(F)F)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5816 |
| logD: | -2.6072 |
| logSw: | -2.1748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.859 |
| InChI Key: | VWZQKYBBXZZPFA-UHFFFAOYSA-N |