N-(2,4-dimethylphenyl)-4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide
N-(2,4-dimethylphenyl)-4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V012-7843 |
| Compound Name: | N-(2,4-dimethylphenyl)-4-{6-propyl-3-[3-(trifluoromethyl)phenyl][1,2]oxazolo[5,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 552.6 |
| Molecular Formula: | C29 H31 F3 N6 O2 |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c(c3cccc(c3)C(F)(F)F)noc2n1)N1CCCN(CC1)C(Nc1ccc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1744 |
| logD: | 7.1739 |
| logSw: | -5.9885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.197 |
| InChI Key: | OKUZGJXVFYRQAO-UHFFFAOYSA-N |