4-{4-[3-(3,4-dichlorophenyl)prop-2-enamido]-1H-pyrazol-1-yl}butanoic acid
Chemical Structure Depiction of
4-{4-[3-(3,4-dichlorophenyl)prop-2-enamido]-1H-pyrazol-1-yl}butanoic acid
4-{4-[3-(3,4-dichlorophenyl)prop-2-enamido]-1H-pyrazol-1-yl}butanoic acid
Compound characteristics
| Compound ID: | 8018-7377 |
| Compound Name: | 4-{4-[3-(3,4-dichlorophenyl)prop-2-enamido]-1H-pyrazol-1-yl}butanoic acid |
| Molecular Weight: | 368.22 |
| Molecular Formula: | C16 H15 Cl2 N3 O3 |
| Smiles: | C(CC(O)=O)Cn1cc(cn1)NC(/C=C/c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6783 |
| logD: | -0.0408 |
| logSw: | -3.5432 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.256 |
| InChI Key: | YBEPWOZQSSZTHU-UHFFFAOYSA-N |