1-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepan-1-yl}-2-(2-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepan-1-yl}-2-(2-fluorophenyl)ethan-1-one
1-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepan-1-yl}-2-(2-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | S259-1507 |
| Compound Name: | 1-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepan-1-yl}-2-(2-fluorophenyl)ethan-1-one |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C19 H24 F N3 O2 |
| Smiles: | Cc1c(CN2CCCN(CC2)C(Cc2ccccc2F)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.3301 |
| logD: | 0.3188 |
| logSw: | -2.3928 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.269 |
| InChI Key: | FKAOHHPWFUOTCH-UHFFFAOYSA-N |