N-(4-{4-[3-acetyl-5-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(3-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-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(3-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide
N-(4-{4-[3-acetyl-5-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(3-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide
Compound characteristics
Compound ID: | G642-5767 |
Compound Name: | N-(4-{4-[3-acetyl-5-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-5-(3-nitrophenyl)-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-yl)acetamide |
Molecular Weight: | 537.88 |
Molecular Formula: | C22 H16 Cl N9 O6 |
Smiles: | CC(Nc1c(non1)n1c(c2cccc(c2)[N+]([O-])=O)c(C2N(C(C)=O)N=C(c3ccc(cc3)[Cl])O2)nn1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.873 |
logD: | 3.6607 |
logSw: | -4.3796 |
Hydrogen bond acceptors count: | 15 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 153.686 |
InChI Key: | DAHXBCCLPYQJKM-JOCHJYFZSA-N |