2-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
2-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Compound characteristics
| Compound ID: | D247-0207 |
| Compound Name: | 2-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide |
| Molecular Weight: | 418.24 |
| Molecular Formula: | C18 H16 Br N3 O4 |
| Smiles: | COc1ccc(cc1OC)c1nc(CNC(c2ccccc2[Br])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.6125 |
| logD: | 3.6124 |
| logSw: | -3.8031 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.256 |
| InChI Key: | XTVLQRLMMTVILW-UHFFFAOYSA-N |