2-{[(4-ethylphenyl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-ethylphenyl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-ethylphenyl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D043-0167 |
| Compound Name: | 2-{[(4-ethylphenyl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C17 H21 N5 O |
| Smiles: | CCCC1=CC(n2c(N1)nc(NCc1ccc(CC)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3345 |
| logD: | 2.9357 |
| logSw: | -3.5392 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.981 |
| InChI Key: | VPWCOLLOUYAOGX-UHFFFAOYSA-N |