N-(2,6-dimethylphenyl)-2-[7-methyl-5-(4-methylphenyl)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[7-methyl-5-(4-methylphenyl)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(2,6-dimethylphenyl)-2-[7-methyl-5-(4-methylphenyl)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M499-1780 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-[7-methyl-5-(4-methylphenyl)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C23 H23 N5 O2 |
| Smiles: | CC1=CC2=NN(CC(Nc3c(C)cccc3C)=O)C(N2C(c2ccc(C)cc2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6632 |
| logD: | 3.5368 |
| logSw: | -3.6908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.478 |
| InChI Key: | YVPRLDCWVJLJRR-UHFFFAOYSA-N |