6-benzyl-2-[(2-ethoxyanilino)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-benzyl-2-[(2-ethoxyanilino)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
6-benzyl-2-[(2-ethoxyanilino)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1489 |
| Compound Name: | 6-benzyl-2-[(2-ethoxyanilino)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 389.46 |
| Molecular Formula: | C22 H23 N5 O2 |
| Smiles: | CCOc1ccccc1NCc1nc2NC(C)=C(Cc3ccccc3)C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6184 |
| logD: | 2.498 |
| logSw: | -3.6513 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.989 |
| InChI Key: | CBYVLTRXBSTLFT-UHFFFAOYSA-N |