3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)propanamide
Chemical Structure Depiction of
3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)propanamide
3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | D481-0042 |
| Compound Name: | 3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethoxyphenyl)propanamide |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C24 H26 N6 O3 |
| Smiles: | CCOc1ccccc1NC(CCC1=C(C)Nc2nc(NCc3ccccc3)nn2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9284 |
| logD: | 2.8852 |
| logSw: | -3.2439 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.282 |
| InChI Key: | RPEALZYBYRXLQC-UHFFFAOYSA-N |