6-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(3-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(3-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(3-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | F830-0209 |
| Compound Name: | 6-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(3-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 477.45 |
| Molecular Formula: | C23 H20 F N7 O4 |
| Smiles: | CCOc1ccc(cc1OC)c1nc(CN2C=Nc3c(C2=O)nnn3Cc2cccc(c2)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.7478 |
| logD: | 2.7478 |
| logSw: | -2.9186 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 99.206 |
| InChI Key: | GCLXPAYVCPUUIR-UHFFFAOYSA-N |