3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-propylpropanamide
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-propylpropanamide
3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-propylpropanamide
Compound characteristics
| Compound ID: | D527-1002 |
| Compound Name: | 3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-propylpropanamide |
| Molecular Weight: | 387.87 |
| Molecular Formula: | C19 H22 Cl N5 O2 |
| Smiles: | [H]C([H])([H])N1C(C)=C(CCC(NCCC)=O)C(n2c1nc(c1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7012 |
| logD: | 2.7012 |
| logSw: | -3.4992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.833 |
| InChI Key: | FSWFGWVMKUEOHB-UHFFFAOYSA-N |