N-(3,4-dimethylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
N-(3,4-dimethylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
Compound characteristics
Compound ID: | D475-1628 |
Compound Name: | N-(3,4-dimethylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide |
Molecular Weight: | 393.47 |
Molecular Formula: | C20 H19 N5 O2 S |
Smiles: | CC1=CC(n2c(nc(c3cccs3)n2)N1CC(Nc1ccc(C)c(C)c1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0676 |
logD: | 4.0676 |
logSw: | -4.0651 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.513 |
InChI Key: | DKHRWAXJTGBLGW-UHFFFAOYSA-N |