2-[(2,5-Dimethylphenyl)methylsulfonyl]pyridine

HCID 501240
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Basic information

Standard SMILES
Cc1ccc(C)c(CS(=O)(=O)c2ccccn2)c1
InChIKey
BMDHVEBVSOVZKT-UHFFFAOYSA-N
Molecular formula
C14H15NO2S
Average molar mass
261.34 g/mol
Monoisotopic mass
261.08234989

Names & identifiers

Preferred name
2-[(2,5-Dimethylphenyl)methylsulfonyl]pyridine
IUPAC
2-[(2,5-dimethylphenyl)methylsulfonyl]pyridine

Names & synonyms

2-[(2,5-dimethylphenyl)methylsulfonyl]pyridineSCHEMBL7253962BMDHVEBVSOVZKT-UHFFFAOYSA-NAKOS0343188922-(2,5-dimethylbenzylsulfonyl)pyridine2-(2,5-Dimethyl-phenylmethanesulfonyl)-pyridineZ432529590

Database identifiers

PubChem CID
501240

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
55.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18

Related reactions

1 records
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Compound notes

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