N-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}methyl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}methyl)-3,4,5-trimethoxybenzamide
N-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}methyl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | 8018-4814 |
| Compound Name: | N-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}methyl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 415.88 |
| Molecular Formula: | C21 H22 Cl N3 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCc1ccc(Cn2cc(cn2)[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.737 |
| logD: | 2.737 |
| logSw: | -3.6653 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.135 |
| InChI Key: | ZWBLMCBKLYJLDK-UHFFFAOYSA-N |