3-{[1-(2,2-difluoroethyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-{[1-(2,2-difluoroethyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
3-{[1-(2,2-difluoroethyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8301 |
| Compound Name: | 3-{[1-(2,2-difluoroethyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 327.29 |
| Molecular Formula: | C13 H15 F2 N5 O3 |
| Smiles: | Cc1c(c(C)n(CC(F)F)n1)NC(c1c(cn(C)n1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5066 |
| logD: | -4.6954 |
| logSw: | -1.5225 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.251 |
| InChI Key: | MFHPHRLYTAJEKZ-UHFFFAOYSA-N |