[3-(2,4-difluorophenoxy)-8-azabicyclo[3.2.1]octan-8-yl](4-{[(5-nitropyridin-2-yl)sulfanyl]methyl}phenyl)methanone
Chemical Structure Depiction of
[3-(2,4-difluorophenoxy)-8-azabicyclo[3.2.1]octan-8-yl](4-{[(5-nitropyridin-2-yl)sulfanyl]methyl}phenyl)methanone
[3-(2,4-difluorophenoxy)-8-azabicyclo[3.2.1]octan-8-yl](4-{[(5-nitropyridin-2-yl)sulfanyl]methyl}phenyl)methanone
Compound characteristics
| Compound ID: | V001-5202 |
| Compound Name: | [3-(2,4-difluorophenoxy)-8-azabicyclo[3.2.1]octan-8-yl](4-{[(5-nitropyridin-2-yl)sulfanyl]methyl}phenyl)methanone |
| Molecular Weight: | 511.55 |
| Molecular Formula: | C26 H23 F2 N3 O4 S |
| Salt: | not_available |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSc2ccc(cn2)[N+]([O-])=O)cc1)=O)Oc1ccc(cc1F)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2568 |
| logD: | 3.2568 |
| logSw: | -3.4014 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.715 |
| InChI Key: | MVKCDBSBOOKDRK-UHFFFAOYSA-N |