2-(3-methylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(3-methylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(3-methylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0443 |
| Compound Name: | 2-(3-methylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 309.37 |
| Molecular Formula: | C17 H19 N5 O |
| Smiles: | Cc1cccc(c1)c1nc2NC(CN3CCCC3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3775 |
| logD: | 0.911 |
| logSw: | -2.9231 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.439 |
| InChI Key: | CMGRCCHELIEDAF-UHFFFAOYSA-N |