2-[(4-ethylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-[(4-ethylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-[(4-ethylanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1724 |
| Compound Name: | 2-[(4-ethylanilino)methyl]-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(CNc1ccc(CC)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3982 |
| logD: | 0.5642 |
| logSw: | -3.6103 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.837 |
| InChI Key: | YERHIQDNWUMQKY-UHFFFAOYSA-N |