N-[4-(cyanomethyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Available: 221 mg
Amount:
mg
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Compound characteristics

Compound ID: D356-0567
Compound Name: N-[4-(cyanomethyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Molecular Weight: 411.52
Molecular Formula: C22 H25 N3 O3 S
Smiles: Cc1ccccc1CS(N1CCC(CC1)C(Nc1ccc(CC#N)cc1)=O)(=O)=O
Stereo: ACHIRAL
logP: 2.7779
logD: 2.7779
logSw: -3.1658
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 72.427
InChI Key: ATSHGDJKJQQFLW-UHFFFAOYSA-N
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