5-bromo-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(difluoromethoxy)benzamide
Chemical Structure Depiction of
5-bromo-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(difluoromethoxy)benzamide
5-bromo-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(difluoromethoxy)benzamide
Compound characteristics
| Compound ID: | Y502-4732 |
| Compound Name: | 5-bromo-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(difluoromethoxy)benzamide |
| Molecular Weight: | 483.37 |
| Molecular Formula: | C21 H21 Br F2 N2 O2 S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(c3cc(ccc3OC(F)F)[Br])=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3494 |
| logD: | 1.5636 |
| logSw: | -5.6227 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.792 |
| InChI Key: | CNVHRXTXHYPTEZ-LLVKDONJSA-N |