1-(4-{6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
Chemical Structure Depiction of
1-(4-{6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
1-(4-{6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
Compound characteristics
| Compound ID: | V009-9210 |
| Compound Name: | 1-(4-{6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one |
| Molecular Weight: | 517.59 |
| Molecular Formula: | C27 H34 F3 N5 O2 |
| Salt: | not_available |
| Smiles: | CCCCCC(N1CCCN(CC1)c1c2c(c3cccc(c3)C(F)(F)F)noc2nc(CC(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8059 |
| logD: | 6.8053 |
| logSw: | -5.8977 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.818 |
| InChI Key: | YSYKUABENXOFAS-UHFFFAOYSA-N |