3-(4-ethoxyphenyl)-6-{[3-(4-ethylphenyl)-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-(4-ethoxyphenyl)-6-{[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-(4-ethoxyphenyl)-6-{[3-(4-ethylphenyl)-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: | F830-0628 |
| Compound Name: | 3-(4-ethoxyphenyl)-6-{[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C23 H21 N7 O3 |
| Smiles: | CCc1ccc(cc1)c1nc(CN2C=Nc3c(C2=O)nnn3c2ccc(cc2)OCC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0645 |
| logD: | 4.0645 |
| logSw: | -3.9582 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.625 |
| InChI Key: | VZCJQOLPVFMLFD-UHFFFAOYSA-N |