2-(4-tert-butylphenyl)-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
2-(4-tert-butylphenyl)-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D351-0276 |
| Compound Name: | 2-(4-tert-butylphenyl)-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 375.9 |
| Molecular Formula: | C19 H25 N5 O |
| Salt: | HCl |
| Smiles: | CCCNCC1=CC(n2c(N1)nc(c1ccc(cc1)C(C)(C)C)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9388 |
| logD: | 2.0548 |
| logSw: | -3.9461 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.219 |
| InChI Key: | RDZFEABCYIIMKR-UHFFFAOYSA-N |