1-{4-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)ethan-1-one
1-{4-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | P891-2011 |
| Compound Name: | 1-{4-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)ethan-1-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | Cc1ccc(CC(N2CCCN(CC2)c2c(cccn2)c2nc(C3CC3)no2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1987 |
| logD: | 3.973 |
| logSw: | -4.2648 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.861 |
| InChI Key: | UNBBMHRAKKHWJF-UHFFFAOYSA-N |