N-(3-chloro-4-methylphenyl)-2-(5-methyl-7-oxo-2-phenyl[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-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
N-(3-chloro-4-methylphenyl)-2-(5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
Compound characteristics
| Compound ID: | D475-1270 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-(5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide |
| Molecular Weight: | 407.86 |
| Molecular Formula: | C21 H18 Cl N5 O2 |
| Smiles: | CC1=CC(n2c(nc(c3ccccc3)n2)N1CC(Nc1ccc(C)c(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6449 |
| logD: | 4.6446 |
| logSw: | -4.7966 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.494 |
| InChI Key: | DYSLJIZTQCADSI-UHFFFAOYSA-N |