N-[2,3-di(pyridin-2-yl)quinoxalin-6-yl]-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane-6-carbothioamide
Chemical Structure Depiction of
N-[2,3-di(pyridin-2-yl)quinoxalin-6-yl]-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane-6-carbothioamide
N-[2,3-di(pyridin-2-yl)quinoxalin-6-yl]-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane-6-carbothioamide
Compound characteristics
| Compound ID: | 5408-3031 |
| Compound Name: | N-[2,3-di(pyridin-2-yl)quinoxalin-6-yl]-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane-6-carbothioamide |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C29 H30 N6 S |
| Smiles: | CC1(C)CC2CC(C)(C1)CN2C(Nc1ccc2c(c1)nc(c1ccccn1)c(c1ccccn1)n2)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5243 |
| logD: | 5.5243 |
| logSw: | -5.6409 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.849 |
| InChI Key: | TVTJBJDKDCVCKW-UHFFFAOYSA-N |