3-chloro-1-(4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)propan-1-one
Chemical Structure Depiction of
3-chloro-1-(4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)propan-1-one
3-chloro-1-(4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)propan-1-one
Compound characteristics
| Compound ID: | V005-3729 |
| Compound Name: | 3-chloro-1-(4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)propan-1-one |
| Molecular Weight: | 495.93 |
| Molecular Formula: | C23 H25 Cl F3 N5 O2 |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c(c3cccc(c3)C(F)(F)F)noc2n1)N1CCCN(CC1)C(CC[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1267 |
| logD: | 5.1263 |
| logSw: | -5.39 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.818 |
| InChI Key: | OSWFHUFGWHXSJV-UHFFFAOYSA-N |