4-{4-[4-(methoxycarbonyl)benzamido]-1H-pyrazol-1-yl}butanoic acid
Chemical Structure Depiction of
4-{4-[4-(methoxycarbonyl)benzamido]-1H-pyrazol-1-yl}butanoic acid
4-{4-[4-(methoxycarbonyl)benzamido]-1H-pyrazol-1-yl}butanoic acid
Compound characteristics
| Compound ID: | 8016-1090 |
| Compound Name: | 4-{4-[4-(methoxycarbonyl)benzamido]-1H-pyrazol-1-yl}butanoic acid |
| Molecular Weight: | 331.33 |
| Molecular Formula: | C16 H17 N3 O5 |
| Smiles: | COC(c1ccc(cc1)C(Nc1cnn(CCCC(O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5812 |
| logD: | -2.138 |
| logSw: | -1.7915 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.643 |
| InChI Key: | CTJDBHPIIHONQI-UHFFFAOYSA-N |