N-(4-{4-[3-acetyl-5-(4-methylphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(4-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide
Chemical Structure Depiction of
N-(4-{4-[3-acetyl-5-(4-methylphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(4-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide
N-(4-{4-[3-acetyl-5-(4-methylphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(4-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide
Compound characteristics
| Compound ID: | G642-5837 |
| Compound Name: | N-(4-{4-[3-acetyl-5-(4-methylphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(4-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide |
| Molecular Weight: | 517.46 |
| Molecular Formula: | C23 H19 N9 O6 |
| Smiles: | CC(Nc1c(non1)n1c(c2ccc(cc2)[N+]([O-])=O)c(C2N(C(C)=O)N=C(c3ccc(C)cc3)O2)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.595 |
| logD: | 3.3826 |
| logSw: | -3.6265 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 153.686 |
| InChI Key: | UJLSFHGGUUZMKC-QHCPKHFHSA-N |