2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-4-[(4-methylphenyl)methyl]-2,4-dihydro-1H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5(7H)-dione
Chemical Structure Depiction of
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-4-[(4-methylphenyl)methyl]-2,4-dihydro-1H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5(7H)-dione
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-4-[(4-methylphenyl)methyl]-2,4-dihydro-1H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5(7H)-dione
Compound characteristics
| Compound ID: | L688-0221 |
| Compound Name: | 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-4-[(4-methylphenyl)methyl]-2,4-dihydro-1H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5(7H)-dione |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C21 H21 N7 O3 |
| Smiles: | Cc1ccc(CN2C3=NN(Cc4c(C)noc4C)C(N3c3cn(C)nc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9326 |
| logD: | 1.9326 |
| logSw: | -2.2027 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 85.42 |
| InChI Key: | LBLZTQKHIVPKQX-UHFFFAOYSA-N |