N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
Compound characteristics
| Compound ID: | 8016-8556 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide |
| Molecular Weight: | 488.53 |
| Molecular Formula: | C23 H23 F3 N6 O S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(Cn3nc(c4cccc(c4)C(F)(F)F)nn3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7873 |
| logD: | 4.9762 |
| logSw: | -5.6783 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.262 |
| InChI Key: | FCCXHPNFLCAIJK-CQSZACIVSA-N |