N-(2,5-dimethylphenyl)-2-(4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-(4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
N-(2,5-dimethylphenyl)-2-(4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
Compound characteristics
Compound ID: | C200-1267 |
Compound Name: | N-(2,5-dimethylphenyl)-2-(4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide |
Molecular Weight: | 377.4 |
Molecular Formula: | C20 H19 N5 O3 |
Smiles: | Cc1ccc(C)c(c1)NC(CN1C2C(C(N(C2=O)c2ccccc2)=O)N=N1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.1653 |
logD: | 1.1652 |
logSw: | -2.3613 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.824 |
InChI Key: | UPNPOCZRHHVCPO-UHFFFAOYSA-N |