2-[(3-methylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-[(3-methylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-[(3-methylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1734 |
| Compound Name: | 2-[(3-methylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 297.36 |
| Molecular Formula: | C16 H19 N5 O |
| Smiles: | CCCC1=CC(n2c(N1)nc(CNc1cccc(C)c1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6999 |
| logD: | -0.134 |
| logSw: | -2.8696 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.837 |
| InChI Key: | KEWDILAUYDTLMG-UHFFFAOYSA-N |