N-(2-chloro-4-methylphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-(2-chloro-4-methylphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2541 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 375.94 |
| Molecular Formula: | C19 H18 Cl N O S2 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(C1=Cc2c(CS1)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0198 |
| logD: | 6.0197 |
| logSw: | -6.0474 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.4914 |
| InChI Key: | SGVHMSKEPVYMAX-UHFFFAOYSA-N |