3-[(2-bromophenoxy)methyl]-N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-4-methoxybenzamide
Chemical Structure Depiction of
3-[(2-bromophenoxy)methyl]-N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-4-methoxybenzamide
3-[(2-bromophenoxy)methyl]-N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | Y501-5538 |
| Compound Name: | 3-[(2-bromophenoxy)methyl]-N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-4-methoxybenzamide |
| Molecular Weight: | 571.27 |
| Molecular Formula: | C25 H21 Br2 N3 O3 |
| Smiles: | COc1ccc(cc1COc1ccccc1[Br])C(Nc1ccc(Cn2cc(cn2)[Br])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5005 |
| logD: | 5.5004 |
| logSw: | -5.3474 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.78 |
| InChI Key: | DAQNBDLOBYWWRQ-UHFFFAOYSA-N |