2-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-7-[(2-methylphenyl)methyl]-6,7-dihydro[1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,5H)-dione
Chemical Structure Depiction of
2-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-7-[(2-methylphenyl)methyl]-6,7-dihydro[1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,5H)-dione
2-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-7-[(2-methylphenyl)methyl]-6,7-dihydro[1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | S448-0114 |
| Compound Name: | 2-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-7-[(2-methylphenyl)methyl]-6,7-dihydro[1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,5H)-dione |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | Cc1ccccc1CN1CCN2C(C1=O)=NN(CC1COc3ccccc3O1)C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2978 |
| logD: | 3.2978 |
| logSw: | -3.2711 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.311 |
| InChI Key: | DBZMVIKIFFASIR-KRWDZBQOSA-N |