AC1OBNV4
[2-[(E)-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyltriazole-4-carbonyl]hydrazinylidene]methyl]-6-methoxyphenyl] 4-chlorobenzoate
Also Known As: (E)-2-((2-(1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazole-4-carbonyl)hydrazono)methyl)-6-methoxyphenyl 4-chlorobenzoate|[2-[(E)-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyltriazole-4-carbonyl]hydrazinylidene]methyl]-6-methoxyphenyl] 4-chlorobenzoate|2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenyl 4-chlorobenzoate
| Molecular Formula | C21H17ClN8O5 |
|---|---|
| Molecular Weight | 496.10104 g/mol |
| LogP | 2.18602 |
| Topological Polar Surface Area | 172.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.10104 |
| Monoisotopic Mass | 496.10104 |
| Heavy Atoms | 35 |
| Complexity | 1413.5983 |
Chemical Identifiers
| CAS Number | 836624-70-5 |
|---|---|
| SMILES | CC1=C(N=NN1C2=NON=C2N)C(=O)N/N=C/C3=C(C(=CC=C3)OC)OC(=O)C4=CC=C(C=C4)Cl |
Product Overview
AC1OBNV4 (CAS 836624-70-5), with molecular formula C21H17ClN8O5 and molecular weight 496.10104 g/mol. IUPAC: [2-[(E)-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyltriazole-4-carbonyl]hydrazinylidene]methyl]-6-methoxyphenyl] 4-chlorobenzoate.
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