2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-[(furan-2-yl)methyl]acetamide
2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | D584-4286 |
| Compound Name: | 2-[6-benzyl-5-methyl-2-(4-methylphenyl)-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C27 H25 N5 O3 |
| Smiles: | [H]C([H])(C1=C(C)N(CC(NCc2ccco2)=O)c2nc(c3ccc(C)cc3)nn2C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8863 |
| logD: | 4.8863 |
| logSw: | -4.6252 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.431 |
| InChI Key: | DTZWKOQPMVLVKM-UHFFFAOYSA-N |