N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y508-5429 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C25 H25 F N2 O3 S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(c3ccc(COc4ccc(cc4)F)o3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3909 |
| logD: | 4.4126 |
| logSw: | -5.7139 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.17 |
| InChI Key: | NCLYXTKBNNQXPH-OAHLLOKOSA-N |