N-{8-[(2H-1,3-benzodioxol-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-yl}-2,4,6-trichlorobenzamide
Chemical Structure Depiction of
N-{8-[(2H-1,3-benzodioxol-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-yl}-2,4,6-trichlorobenzamide
N-{8-[(2H-1,3-benzodioxol-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-yl}-2,4,6-trichlorobenzamide
Compound characteristics
| Compound ID: | V002-8942 |
| Compound Name: | N-{8-[(2H-1,3-benzodioxol-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-yl}-2,4,6-trichlorobenzamide |
| Molecular Weight: | 467.78 |
| Molecular Formula: | C22 H21 Cl3 N2 O3 |
| Salt: | not_available |
| Smiles: | C1CC2CC(CC1N2Cc1ccc2c(c1)OCO2)NC(c1c(cc(cc1[Cl])[Cl])[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5708 |
| logD: | 2.308 |
| logSw: | -5.1367 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.236 |
| InChI Key: | OVTGBHFZARKHAN-UHFFFAOYSA-N |