3-benzyl-6-{[3-(3-methoxyphenyl)-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-benzyl-6-{[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-benzyl-6-{[3-(3-methoxyphenyl)-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: | F830-0757 |
| Compound Name: | 3-benzyl-6-{[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 415.41 |
| Molecular Formula: | C21 H17 N7 O3 |
| Smiles: | COc1cccc(c1)c1nc(CN2C=Nc3c(C2=O)nnn3Cc2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.718 |
| logD: | 2.7179 |
| logSw: | -3.109 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.909 |
| InChI Key: | HASMMDUUOYESHC-UHFFFAOYSA-N |