3-[(4-chlorophenyl)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-[(4-chlorophenyl)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-[(4-chlorophenyl)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: | F830-0114 |
| Compound Name: | 3-[(4-chlorophenyl)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: | 425.85 |
| Molecular Formula: | C18 H12 Cl N7 O2 S |
| Smiles: | C(c1nc(c2cccs2)no1)N1C=Nc2c(C1=O)nnn2Cc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9137 |
| logD: | 2.9137 |
| logSw: | -3.4036 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 85.383 |
| InChI Key: | RYBMWAFXSCNZAL-UHFFFAOYSA-N |