N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
Compound characteristics
| Compound ID: | G856-7175 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C18 H18 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(CC(Nc1c(C#N)c2CCCCc2s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2557 |
| logD: | 1.7916 |
| logSw: | -3.7458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.924 |
| InChI Key: | KTDLUVXVLNNQRO-UHFFFAOYSA-N |