N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Compound characteristics
Compound ID: | 8006-9350 |
Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide |
Molecular Weight: | 429.56 |
Molecular Formula: | C21 H23 N3 O3 S2 |
Smiles: | C1CCN(CC1)S(c1cccc(c1)C(Nc1c(C#N)c2CCCCc2s1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8552 |
logD: | 0.592 |
logSw: | -4.2693 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.812 |
InChI Key: | WWOFWAKZSCRUMO-UHFFFAOYSA-N |