N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-4-[(4-bromophenoxy)methyl]benzamide
Chemical Structure Depiction of
N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-4-[(4-bromophenoxy)methyl]benzamide
N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-4-[(4-bromophenoxy)methyl]benzamide
Compound characteristics
| Compound ID: | Y501-8431 |
| Compound Name: | N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-4-[(4-bromophenoxy)methyl]benzamide |
| Molecular Weight: | 569.3 |
| Molecular Formula: | C26 H23 Br2 N3 O2 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)NC(c2ccc(COc3ccc(cc3)[Br])cc2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.8345 |
| logD: | 5.8345 |
| logSw: | -5.5381 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.839 |
| InChI Key: | HIAYRBCMONXAEQ-UHFFFAOYSA-N |