7-methyl-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]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
7-methyl-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]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
7-methyl-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]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: | L688-0225 |
| Compound Name: | 7-methyl-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]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: | 495.54 |
| Molecular Formula: | C27 H25 N7 O3 |
| Smiles: | Cc1ccc(CN2C3=NN(Cc4c(C)oc(c5ccc(C)cc5)n4)C(N3c3cn(C)nc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7918 |
| logD: | 3.7918 |
| logSw: | -3.8 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.504 |
| InChI Key: | MJSAXTSKRLOGDL-UHFFFAOYSA-N |