3-(3-chlorophenyl)-6-{[3-(3,4,5-trimethoxyphenyl)-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-chlorophenyl)-6-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-(3-chlorophenyl)-6-{[3-(3,4,5-trimethoxyphenyl)-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: | F830-0438 |
| Compound Name: | 3-(3-chlorophenyl)-6-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 495.88 |
| Molecular Formula: | C22 H18 Cl N7 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(CN2C=Nc3c(C2=O)nnn3c2cccc(c2)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 2.8818 |
| logD: | 2.8818 |
| logSw: | -3.4386 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 107.479 |
| InChI Key: | UHXIBSGQEDAQIG-UHFFFAOYSA-N |