4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0912 |
| Compound Name: | 4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 249.24 |
| Molecular Formula: | C12 H12 F N3 O2 |
| Smiles: | Cn1cc(c(C(O)=O)n1)NCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 0.6257 |
| logD: | -2.1355 |
| logSw: | -1.6557 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.539 |
| InChI Key: | KIXNIUAETWSGQI-UHFFFAOYSA-N |