5-methyl-2-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-2-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-2-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-0751 |
| Compound Name: | 5-methyl-2-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 305.76 |
| Molecular Formula: | C14 H15 N5 O |
| Salt: | HCl |
| Smiles: | CC1=CC(n2c(N1)nc(CNc1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7923 |
| logD: | -0.5949 |
| logSw: | -2.2359 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.23 |
| InChI Key: | MMQHPQDHISIMBG-UHFFFAOYSA-N |