ethyl 4-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamido}benzoate
Chemical Structure Depiction of
ethyl 4-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamido}benzoate
ethyl 4-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamido}benzoate
Compound characteristics
| Compound ID: | Y500-6319 |
| Compound Name: | ethyl 4-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamido}benzoate |
| Molecular Weight: | 383.83 |
| Molecular Formula: | C20 H18 Cl N3 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1ccc(Cn2cc(cn2)[Cl])cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8918 |
| logD: | 3.8876 |
| logSw: | -4.3152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.589 |
| InChI Key: | AIZDFYPKTKEPFC-UHFFFAOYSA-N |