2-{[(4-methoxyphenyl)methyl]amino}-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-methoxyphenyl)methyl]amino}-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-methoxyphenyl)methyl]amino}-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0202 |
| Compound Name: | 2-{[(4-methoxyphenyl)methyl]amino}-5-[(propylamino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C17 H22 N6 O2 |
| Smiles: | CCCNCC1=CC(n2c(N1)nc(NCc1ccc(cc1)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5442 |
| logD: | -0.3398 |
| logSw: | -1.9959 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.404 |
| InChI Key: | UNXGBTSPMRFSMZ-UHFFFAOYSA-N |