N-(3-chloro-2-methylphenyl)-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-chloro-2-methylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
N-(3-chloro-2-methylphenyl)-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: | D475-1638 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide |
| Molecular Weight: | 413.88 |
| Molecular Formula: | C19 H16 Cl N5 O2 S |
| Smiles: | CC1=CC(n2c(nc(c3cccs3)n2)N1CC(Nc1cccc(c1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8875 |
| logD: | 3.8871 |
| logSw: | -4.1079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.815 |
| InChI Key: | CRFHKRAFCATOGV-UHFFFAOYSA-N |