1-{2-[(4-bromophenoxy)methyl]-5-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{2-[(4-bromophenoxy)methyl]-5-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
1-{2-[(4-bromophenoxy)methyl]-5-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | G642-6601 |
| Compound Name: | 1-{2-[(4-bromophenoxy)methyl]-5-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one |
| Molecular Weight: | 513.3 |
| Molecular Formula: | C22 H17 Br N4 O6 |
| Smiles: | CC(N1C(COc2ccc(cc2)[Br])OC(c2ccc(cc2)Oc2ccc(cn2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5656 |
| logD: | 4.5656 |
| logSw: | -4.3478 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 92.112 |
| InChI Key: | XWHAVJPUHVKVPH-NRFANRHFSA-N |