N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-4-[(3-bromophenoxy)methyl]benzamide
Chemical Structure Depiction of
N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-4-[(3-bromophenoxy)methyl]benzamide
N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-4-[(3-bromophenoxy)methyl]benzamide
Compound characteristics
| Compound ID: | Y501-4498 |
| Compound Name: | N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-4-[(3-bromophenoxy)methyl]benzamide |
| Molecular Weight: | 490.4 |
| Molecular Formula: | C26 H24 Br N3 O2 |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2)n1)NC(c1ccc(COc2cccc(c2)[Br])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6911 |
| logD: | 4.6883 |
| logSw: | -4.6887 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.443 |
| InChI Key: | GATDNMZVWXGMCP-UHFFFAOYSA-N |