6-chloro-2-{[(2-fluorophenyl)methyl]amino}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-chloro-2-{[(2-fluorophenyl)methyl]amino}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
6-chloro-2-{[(2-fluorophenyl)methyl]amino}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D298-0439 |
| Compound Name: | 6-chloro-2-{[(2-fluorophenyl)methyl]amino}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 307.71 |
| Molecular Formula: | C13 H11 Cl F N5 O |
| Smiles: | CC1=C(C(n2c(N1)nc(NCc1ccccc1F)n2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.585 |
| logD: | 0.9599 |
| logSw: | -3.4552 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.892 |
| InChI Key: | HVKOBKHARAJIER-UHFFFAOYSA-N |