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4-[(1S)-1-aminochloranuidyl-2-(3,5-difluorophenyl)ethyl]-5-bromopyrimidine;5-bromo-4-[(2S)-1-[(S)-tert-butylsulfinyl]-3-(3,5-difluorophenyl)propan-2-yl]pyrimidine;3-[4-[(2R)-1-(3,5-difluorophenyl)-5-(6-hydroxy-3H-inden-1-yl)-4-oxopentan-2-yl]pyrimidin-5-yl]benzenesulfonamide;2-(6-hydroxy-3H-inden-1-yl)acetic acid;methane;(3-sulfamoylphenyl)boronic acid

HCID 160056818
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
No structure available

Basic information

InChIKey
OOVYTKLZBSQLIH-QZAUAYGMSA-N
Molecular formula
C77H76BBr2ClF6N9O12S3-
Average molar mass
1,735.7 g/mol

Names & identifiers

Preferred name
4-[(1S)-1-aminochloranuidyl-2-(3,5-difluorophenyl)ethyl]-5-bromopyrimidine;5-bromo-4-[(2S)-1-[(S)-tert-butylsulfinyl]-3-(3,5-difluorophenyl)propan-2-yl]pyrimidine;3-[4-[(2R)-1-(3,5-difluorophenyl)-5-(6-hydroxy-3H-inden-1-yl)-4-oxopentan-2-yl]pyrimidin-5-yl]benzenesulfonamide;2-(6-hydroxy-3H-inden-1-yl)acetic acid;methane;(3-sulfamoylphenyl)boronic acid
IUPAC
4-[(1S)-1-aminochloranuidyl-2-(3,5-difluorophenyl)ethyl]-5-bromopyrimidine;5-bromo-4-[(2S)-1-[(S)-tert-butylsulfinyl]-3-(3,5-difluorophenyl)propan-2-yl]pyrimidine;3-[4-[(2R)-1-(3,5-difluorophenyl)-5-(6-hydroxy-3H-inden-1-yl)-4-oxopentan-2-yl]pyrimidin-5-yl]benzenesulfonamide;2-(6-hydroxy-3H-inden-1-yl)acetic acid;methane;(3-sulfamoylphenyl)boronic acid

Database identifiers

PubChem CID
160056818

Properties

Computed structural propertiesFilling in

Topological polar surface area
412 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
29
Rotatable bonds
22
Heavy atoms
111
Formal charge
-1
Complexity
2,240

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes