ethyl [4-(3-chlorobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
Chemical Structure Depiction of
ethyl [4-(3-chlorobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
ethyl [4-(3-chlorobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
Compound characteristics
| Compound ID: | 8016-3612 |
| Compound Name: | ethyl [4-(3-chlorobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate |
| Molecular Weight: | 335.79 |
| Molecular Formula: | C16 H18 Cl N3 O3 |
| Smiles: | CCOC(Cn1c(C)c(c(C)n1)NC(c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8076 |
| logD: | 1.7828 |
| logSw: | -2.8627 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.646 |
| InChI Key: | DFUBHWWXOYQSBH-UHFFFAOYSA-N |