N-(5-chloro-2-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-(5-chloro-2-methoxyphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2576 |
| Compound Name: | N-(5-chloro-2-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(cc1NC(C1=Cc2c(CS1)c1CCCCc1s2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5488 |
| logD: | 5.5478 |
| logSw: | -5.8033 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.1218 |
| InChI Key: | GRGNDMSQRAFOIQ-UHFFFAOYSA-N |