ethyl [4-(2-iodobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
Chemical Structure Depiction of
ethyl [4-(2-iodobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
ethyl [4-(2-iodobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate
Compound characteristics
| Compound ID: | 8016-3628 |
| Compound Name: | ethyl [4-(2-iodobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl]acetate |
| Molecular Weight: | 427.24 |
| Molecular Formula: | C16 H18 I N3 O3 |
| Smiles: | CCOC(Cn1c(C)c(c(C)n1)NC(c1ccccc1I)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5441 |
| logD: | 1.5169 |
| logSw: | -2.5687 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.646 |
| InChI Key: | JWDRDIWDAIPNCC-UHFFFAOYSA-N |