N-(4-bromophenyl)-2-(2-cyclohexyl-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(2-cyclohexyl-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
N-(4-bromophenyl)-2-(2-cyclohexyl-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
Compound characteristics
| Compound ID: | D475-1686 |
| Compound Name: | N-(4-bromophenyl)-2-(2-cyclohexyl-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide |
| Molecular Weight: | 444.33 |
| Molecular Formula: | C20 H22 Br N5 O2 |
| Smiles: | CC1=CC(n2c(nc(C3CCCCC3)n2)N1CC(Nc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3555 |
| logD: | 4.3553 |
| logSw: | -4.2999 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.687 |
| InChI Key: | HHPQFUBBDKSUJV-UHFFFAOYSA-N |