N-(3-chloro-4-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-(3-chloro-4-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2593 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 391.94 |
| Molecular Formula: | C19 H18 Cl N O2 S2 |
| Smiles: | COc1ccc(cc1[Cl])NC(C1=Cc2c(CS1)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6083 |
| logD: | 5.6083 |
| logSw: | -5.889 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.82 |
| InChI Key: | FRSPFBAKTNQXFI-UHFFFAOYSA-N |