Organofluorine / Alfa Chemistry
6-Chloro-N-(4-cyano-2-fluorophenyl)-1H-indole-3-sulfonamide

6-Chloro-N-(4-cyano-2-fluorophenyl)-1H-indole-3-sulfonamide

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6-Chloro-N-(4-cyano-2-fluorophenyl)-1H-indole-3-sulfonamide
Catalog OFC2231230592
CAS 2231230-59-2
Category Fluorinated Indoles
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 6-chloro-N-(4-cyano-2-fluorophenyl)-1H-indole-3-sulfonamide
InChI InChI=1S/C15H9ClFN3O2S/c16-10-2-3-11-14(6-10)19-8-15(11)23(21,22)20-13-4-1-9(7-18)5-12(13)17/h1-6,8,19-20H
InChI Key WTVQVSRDWJPLPV-UHFFFAOYSA-N
Isomeric SMILES C1=CC(=C(C=C1C#N)F)NS(=O)(=O)C2=CNC3=C2C=CC(=C3)Cl
Molecular Formula C15H9ClFN3O2S
Molecular Weight 349.77
Storage Sealed in dry, 2-8 °C
XLogP3-AA 3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 349.0088036 g/mol
Monoisotopic Mass 349.0088036 g/mol
Topological Polar Surface Area 94.1Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 587

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