5-bromo-N-{4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl}furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-{4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl}furan-2-carboxamide
5-bromo-N-{4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | K907-0005 |
| Compound Name: | 5-bromo-N-{4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl}furan-2-carboxamide |
| Molecular Weight: | 500.3 |
| Molecular Formula: | C22 H18 Br N3 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(c2ccc(cc2)NC(c2ccc(o2)[Br])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.7578 |
| logD: | 4.7571 |
| logSw: | -4.6298 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.639 |
| InChI Key: | LYUOFPHCCSWVLQ-UHFFFAOYSA-N |