5-(4-ethylphenyl)-1-[(2,4,6-trimethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
5-(4-ethylphenyl)-1-[(2,4,6-trimethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
5-(4-ethylphenyl)-1-[(2,4,6-trimethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C433-0652 |
| Compound Name: | 5-(4-ethylphenyl)-1-[(2,4,6-trimethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C22 H24 N4 O2 |
| Smiles: | CCc1ccc(cc1)N1C(C2C(C1=O)N(Cc1c(C)cc(C)cc1C)N=N2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1442 |
| logD: | 4.144 |
| logSw: | -4.1304 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.373 |
| InChI Key: | YRINRQUYHAADQY-UHFFFAOYSA-N |