4-[(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid
4-[(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | Y501-0061 |
| Compound Name: | 4-[(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid |
| Molecular Weight: | 301.34 |
| Molecular Formula: | C16 H19 N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2)n1)NC(CCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4166 |
| logD: | -2.5328 |
| logSw: | -1.9164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.658 |
| InChI Key: | WGPIWBGIJMNWCF-UHFFFAOYSA-N |