1-benzyl-5-(methoxycarbonyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-benzyl-5-(methoxycarbonyl)-1H-pyrazole-3-carboxylic acid
1-benzyl-5-(methoxycarbonyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-3925 |
| Compound Name: | 1-benzyl-5-(methoxycarbonyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 260.25 |
| Molecular Formula: | C13 H12 N2 O4 |
| Smiles: | COC(c1cc(C(O)=O)nn1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1493 |
| logD: | -2.0369 |
| logSw: | -1.7398 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.779 |
| InChI Key: | ZRSAWPOSBYQGRX-UHFFFAOYSA-N |