1-(azepan-1-yl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
1-(azepan-1-yl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Compound characteristics
| Compound ID: | D458-0615 |
| Compound Name: | 1-(azepan-1-yl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one |
| Molecular Weight: | 369.51 |
| Molecular Formula: | C21 H31 N5 O |
| Smiles: | Cc1c(CC(N2CCCCCC2)=O)c(C)n2c(n1)nc(C1CCCCC1)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.6486 |
| logD: | 3.6485 |
| logSw: | -3.8056 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.749 |
| InChI Key: | HVBYLBOFKVQGJE-UHFFFAOYSA-N |