5-bromo-2-methoxy-N-{3-[3-methoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzene-1-sulfonamide
Chemical Structure Depiction of
5-bromo-2-methoxy-N-{3-[3-methoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzene-1-sulfonamide
5-bromo-2-methoxy-N-{3-[3-methoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V004-9800 |
| Compound Name: | 5-bromo-2-methoxy-N-{3-[3-methoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzene-1-sulfonamide |
| Molecular Weight: | 545.41 |
| Molecular Formula: | C23 H21 Br N4 O5 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1nc(nn1c1cccc(c1)NS(c1cc(ccc1OC)[Br])(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.4528 |
| logD: | 5.4483 |
| logSw: | -5.6571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.058 |
| InChI Key: | OWHUJGMDSODEBG-UHFFFAOYSA-N |