N-(2-bromophenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-(2-bromophenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2487 |
| Compound Name: | N-(2-bromophenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 406.36 |
| Molecular Formula: | C18 H16 Br N O S2 |
| Smiles: | C1CCc2c(C1)c1CSC(=Cc1s2)C(Nc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5587 |
| logD: | 5.5587 |
| logSw: | -5.6675 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.4914 |
| InChI Key: | NMPQEJUFWWJUGA-UHFFFAOYSA-N |