2-(3,4-dimethylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
2-(3,4-dimethylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D489-0166 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 359.86 |
| Molecular Formula: | C18 H21 N5 O |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1C)c1nc2NC(CN3CCCC3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9923 |
| logD: | 1.5258 |
| logSw: | -3.0851 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.439 |
| InChI Key: | NZCIJCREFDMSBX-UHFFFAOYSA-N |