5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C433-0508 |
| Compound Name: | 5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C19 H18 N4 O4 |
| Smiles: | COc1ccc(CN2C3C(C(N(C3=O)c3ccc(cc3)OC)=O)N=N2)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6232 |
| logD: | 1.6231 |
| logSw: | -2.0222 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.46 |
| InChI Key: | OWFXYIULEXPAEA-UHFFFAOYSA-N |