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2-Chloro-N-{5-[4-(morpholine-4-sulfonyl)-phenylsulfanyl]-6-trifluoromethyl-pyridin-2-yl}-4-trifluoromethyl-benzenesulfonamide

HCID 57718236
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=S(=O)(Nc1ccc(Sc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1Cl
InChIKey
DRJCSSTXYUXCME-UHFFFAOYSA-N
Molecular formula
C23H18ClF6N3O5S3
Average molar mass
662 g/mol

Names & identifiers

Preferred name
2-Chloro-N-{5-[4-(morpholine-4-sulfonyl)-phenylsulfanyl]-6-trifluoromethyl-pyridin-2-yl}-4-trifluoromethyl-benzenesulfonamide
IUPAC
2-chloro-N-[5-(4-morpholin-4-ylsulfonylphenyl)sulfanyl-6-(trifluoromethyl)-2-pyridinyl]-4-(trifluoromethyl)benzenesulfonamide

Names & synonyms

2-Chloro-N-{5-[4-(morpholine-4-sulfonyl)-phenylsulfanyl]-6-trifluoromethyl-pyridin-2-yl}-4-trifluoromethyl-benzenesulfonamideSCHEMBL1268685

Database identifiers

PubChem CID
57718236

Properties

Computed structural properties

XLogP
5
Topological polar surface area
148 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
15
Rotatable bonds
7
Heavy atoms
41
Formal charge
0
Complexity
1,090

Related reactions

2 records
New reaction record
HRID 1366850 reaction equation
HRID 1366850As productuspto-grants-2011_02
HRID 1984601 reaction equation
HRID 1984601As productuspto-grants-2009_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes