Vitas-M small molecule compound

1-[(2-chloro-6-fluorobenzyl)sulfonyl]azepane

Catalog ID
STL223758
SMILES Fc1cccc(c1CS(=O)(=O)N1CCCCCC1)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H17ClFNO2S MW 305.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17ClFNO2S/c14-12-6-5-7-13(15)11(12)10-19(17,18)16-8-3-1-2-4-9-16/h5-7H,1-4,8-10H2
InChIKey
ICAVPPBLGJRWOF-UHFFFAOYSA-N
Synonyms

1((2chloro6fluorobenzyl)sulfonyl)azepane
1((2chloro6fluorophenyl)methylsulfonyl)azepane
C1CCCN(CC1)S(=O)(=O)CC2=C(C=CC=C2Cl)F
InChI=1SC13H17ClFNO2Sc141265713(15)11(12)1019(1718)1683124916h57H14810H2
MFCD09871486
ZINC000016578368
ZINC16578368

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.