3-[(4-chlorophenyl)methyl]-6-[(2,5-dimethylphenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-6-[(2,5-dimethylphenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(4-chlorophenyl)methyl]-6-[(2,5-dimethylphenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0285 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-6-[(2,5-dimethylphenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 379.85 |
| Molecular Formula: | C20 H18 Cl N5 O |
| Smiles: | Cc1ccc(C)c(CN2C=Nc3c(C2=O)nnn3Cc2ccc(cc2)[Cl])c1 |
| Stereo: | ACHIRAL |
| logP: | 3.998 |
| logD: | 3.998 |
| logSw: | -4.3009 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.022 |
| InChI Key: | PKUBUAGWUUSGCL-UHFFFAOYSA-N |