2-{[(4-methoxyphenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-methoxyphenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-methoxyphenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0212 |
| Compound Name: | 2-{[(4-methoxyphenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C18 H22 N6 O2 |
| Smiles: | COc1ccc(CNc2nc3NC(CN4CCCC4)=CC(n3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.408 |
| logD: | 1.408 |
| logSw: | -2.1364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.623 |
| InChI Key: | SCRSLCCCYFTBIB-UHFFFAOYSA-N |