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Home Amines 401822-72-8
401822-72-8,MFCD00590216
Catalog No.:AA00I7T5

401822-72-8 | 2-[Methyl(methylsulfonyl)amino]benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
2 weeks  
$410.00   $287.00
- +
5g
>95%
2 weeks  
$1,143.00   $800.00
- +
10g
>95%
2 weeks  
$1,654.00   $1,158.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I7T5
Chemical Name:
2-[Methyl(methylsulfonyl)amino]benzoic acid
CAS Number:
401822-72-8
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
MDL Number:
MFCD00590216
SMILES:
OC(=O)c1ccccc1N(S(=O)(=O)C)C
Properties
Computed Properties
 
Complexity:
333  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.6  

Downstream Synthesis Route
401822-72-8   
(S)-5,6-dimethyl-2-(piperidin-2-yl)pyrazolo1,5-apyrimidin-7(4H)-onedihydrochloride 
  76-05-1   
(x)C2HF3O2*C22H27N5O4S 

[1]CurrentPatentAssignee:GILEADSCIENCESINC;SAUNDERSOLIVERL;MACKMANRICHARDL;SPERANDIODAVID;PARRISHJAYP;SANGIMICHAEL;HUIHONCHUNG;EISENBERGEUGENEJ;SIEGELDUSTIN;BABAOGLUKERIM;BOOJAMRACONSTANTINEG;YANGHAI-WO2011/163518,2011,A1Locationinpatent:Page/Pagecolumn178-179

401822-72-8   
(S)-5,6-dimethyl-2-(piperidin-2-yl)pyrazolo1,5-apyrimidin-7(4H)-onedihydrochloride 
  76-05-1   
(S)-N-(2-(2-(5,6-dimethyl-7-oxo-4,7-dihydropyrazolo1,5-apyrimidin-2-yl)piperidine-1-carbonyl)phenyl)-N-methylmethanesulfonamidetrifluoroaceticacidsalt 

[1]Mackman,RichardL.;Sangi,Michael;Sperandio,David;Parrish,JayP.;Eisenberg,Eugene;Perron,Michel;Hui,Hon;Zhang,Lijun;Siegel,Dustin;Yang,Hai;Saunders,Oliver;Boojamra,Constantine;Lee,Gary;Samuel,Dharmaraj;Babaoglu,Kerim;Carey,Anne;Gilbert,BrianE.;Piedra,PedroA.;Strickley,Robert;Iwata,Quynh;Hayes,Jaclyn;Stray,Kirsten;Kinkade,April;Theodore,Dorothy;Jordan,Robert;Desai,Manoj;Cihlar,Tomas[JournalofMedicinalChemistry,2015,vol.58,#4,p.1630-1643]

[1]Ukrainets;Petrushova;Dzyubenko;Yangyang,Liu[ChemistryofHeterocyclicCompounds,2014,vol.50,#7,p.1047-1052][Khim.Geterotsikl.Soedin.,2014,vol.50,#7,p.1135-1140,6]

401822-72-8   
C21H28N4O5S*ClH 
 
(4S,7R)-N,N-dimethyl-7-((S)-1-(2-(N-methylmethylsulfonamido)benzoyl)pyrrolidine-2-carboxamido)-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzoj1,8,5oxathiaazacyclododecine-4-carboxamide 

[1]Begnini,Fabio;Geschwindner,Stefan;Johansson,Patrik;Wissler,Lisa;Lewis,RichardJ.;Danelius,Emma;Luttens,Andreas;Matricon,Pierre;Carlsson,Jens;Lenders,Stijn;König,Beate;Friedel,Anna;Sjö,Peter;Schiesser,Stefan;Kihlberg,Jan[JournalofMedicinalChemistry,2022,vol.65,#4,p.3473-3517]

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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