6-[(2,5-dimethylphenyl)methyl]-3-[(4-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(2,5-dimethylphenyl)methyl]-3-[(4-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[(2,5-dimethylphenyl)methyl]-3-[(4-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0150 |
| Compound Name: | 6-[(2,5-dimethylphenyl)methyl]-3-[(4-fluorophenyl)methyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C20 H18 F N5 O |
| Smiles: | Cc1ccc(C)c(CN2C=Nc3c(C2=O)nnn3Cc2ccc(cc2)F)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4324 |
| logD: | 3.4323 |
| logSw: | -3.3523 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.022 |
| InChI Key: | QKYHBZLVDKFOKU-UHFFFAOYSA-N |