1-[5-(3-bromophenyl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(3-bromophenyl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-(3-bromophenyl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-0490 |
| Compound Name: | 1-[5-(3-bromophenyl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 390.19 |
| Molecular Formula: | C16 H12 Br N3 O4 |
| Smiles: | CC(N1C(c2ccc(cc2)[N+]([O-])=O)OC(c2cccc(c2)[Br])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0437 |
| logD: | 4.0437 |
| logSw: | -4.1436 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.633 |
| InChI Key: | VMABBSGTNRMWQQ-MRXNPFEDSA-N |