N-(3-chloro-4-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-4-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-4-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: | D475-1636 |
| Compound Name: | N-(3-chloro-4-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(Nc1ccc(C)c(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4704 |
| logD: | 4.4701 |
| logSw: | -4.4694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.513 |
| InChI Key: | NPVFTQHONLICPD-UHFFFAOYSA-N |