3-(3,4-dimethylphenyl)-6-{[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-6-{[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-(3,4-dimethylphenyl)-6-{[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | F830-0720 |
| Compound Name: | 3-(3,4-dimethylphenyl)-6-{[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C23 H21 N7 O2 |
| Smiles: | Cc1ccc(cc1C)c1nc(CN2C=Nc3c(C2=O)nnn3c2ccc(C)c(C)c2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8765 |
| logD: | 4.8765 |
| logSw: | -4.648 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.501 |
| InChI Key: | GJTWOOBRORCSHZ-UHFFFAOYSA-N |