3-[(2-methylphenyl)methyl]-6-{[3-(thiophen-2-yl)-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-[(2-methylphenyl)methyl]-6-{[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(2-methylphenyl)methyl]-6-{[3-(thiophen-2-yl)-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: | F830-0054 |
| Compound Name: | 3-[(2-methylphenyl)methyl]-6-{[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 405.44 |
| Molecular Formula: | C19 H15 N7 O2 S |
| Smiles: | Cc1ccccc1Cn1c2c(C(N(Cc3nc(c4cccs4)no3)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.11 |
| logD: | 3.1099 |
| logSw: | -3.0075 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 85.383 |
| InChI Key: | GFASTJUPDVNQDA-UHFFFAOYSA-N |