N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-bromobenzamide
Chemical Structure Depiction of
N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-bromobenzamide
N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-bromobenzamide
Compound characteristics
| Compound ID: | Y501-0692 |
| Compound Name: | N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-bromobenzamide |
| Molecular Weight: | 384.27 |
| Molecular Formula: | C19 H18 Br N3 O |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2)n1)NC(c1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8199 |
| logD: | 2.8004 |
| logSw: | -3.5767 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.216 |
| InChI Key: | WSHINXGPIORYDA-UHFFFAOYSA-N |