N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methoxybenzamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methoxybenzamide
Compound characteristics
Compound ID: | 8003-5294 |
Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methoxybenzamide |
Molecular Weight: | 312.39 |
Molecular Formula: | C17 H16 N2 O2 S |
Smiles: | COc1ccccc1C(Nc1c(C#N)c2CCCCc2s1)=O |
Stereo: | ACHIRAL |
logP: | 3.5022 |
logD: | -0.3851 |
logSw: | -4.1353 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.731 |
InChI Key: | JWEWISPZFGVKEZ-UHFFFAOYSA-N |