3-[(2-bromophenoxy)methyl]-4-methoxy-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
Chemical Structure Depiction of
3-[(2-bromophenoxy)methyl]-4-methoxy-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
3-[(2-bromophenoxy)methyl]-4-methoxy-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide
Compound characteristics
| Compound ID: | Y501-5534 |
| Compound Name: | 3-[(2-bromophenoxy)methyl]-4-methoxy-N-{4-[(1H-pyrazol-1-yl)methyl]phenyl}benzamide |
| Molecular Weight: | 492.37 |
| Molecular Formula: | C25 H22 Br N3 O3 |
| Smiles: | COc1ccc(cc1COc1ccccc1[Br])C(Nc1ccc(Cn2cccn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6099 |
| logD: | 4.6097 |
| logSw: | -4.4382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.797 |
| InChI Key: | BPKDRAKVMXRKCC-UHFFFAOYSA-N |