6-[(2-chloro-6-fluorophenyl)methyl]-3-(4-methylphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(2-chloro-6-fluorophenyl)methyl]-3-(4-methylphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[(2-chloro-6-fluorophenyl)methyl]-3-(4-methylphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0363 |
| Compound Name: | 6-[(2-chloro-6-fluorophenyl)methyl]-3-(4-methylphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 369.78 |
| Molecular Formula: | C18 H13 Cl F N5 O |
| Smiles: | Cc1ccc(cc1)n1c2c(C(N(Cc3c(cccc3[Cl])F)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.3426 |
| logD: | 3.3426 |
| logSw: | -3.4941 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.158 |
| InChI Key: | AYHOOLDSOSROIL-UHFFFAOYSA-N |