4-[3-acetyl-5-(3-bromophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-1,2-phenylene diacetate
Chemical Structure Depiction of
4-[3-acetyl-5-(3-bromophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-1,2-phenylene diacetate
4-[3-acetyl-5-(3-bromophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-1,2-phenylene diacetate
Compound characteristics
Compound ID: | G642-1777 |
Compound Name: | 4-[3-acetyl-5-(3-bromophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-1,2-phenylene diacetate |
Molecular Weight: | 461.27 |
Molecular Formula: | C20 H17 Br N2 O6 |
Smiles: | CC(N1C(c2ccc(c(c2)OC(C)=O)OC(C)=O)OC(c2cccc(c2)[Br])=N1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7279 |
logD: | 3.7279 |
logSw: | -4.1256 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 76.927 |
InChI Key: | SWQWOCNODUYECC-HXUWFJFHSA-N |