2-[(5-chloro-2-methoxyanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-[(5-chloro-2-methoxyanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-[(5-chloro-2-methoxyanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1726 |
| Compound Name: | 2-[(5-chloro-2-methoxyanilino)methyl]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 347.8 |
| Molecular Formula: | C16 H18 Cl N5 O2 |
| Smiles: | CCCC1=CC(n2c(N1)nc(CNc1cc(ccc1OC)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9531 |
| logD: | 0.1192 |
| logSw: | -3.5747 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.77 |
| InChI Key: | DXPMDBJTVLJSKL-UHFFFAOYSA-N |