N-methyl-2-[5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-phenylacetamide
Chemical Structure Depiction of
N-methyl-2-[5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-phenylacetamide
N-methyl-2-[5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-phenylacetamide
Compound characteristics
Compound ID: | C338-0129 |
Compound Name: | N-methyl-2-[5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-phenylacetamide |
Molecular Weight: | 377.4 |
Molecular Formula: | C20 H19 N5 O3 |
Smiles: | Cc1ccc(cc1)N1C(C2C(C1=O)N(CC(N(C)c1ccccc1)=O)N=N2)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 0.8655 |
logD: | 0.8655 |
logSw: | -1.3937 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 72.486 |
InChI Key: | ONEYCAGBOWKTDM-UHFFFAOYSA-N |