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64826-45-5,MFCD03721869
Catalog No.:AA0036Z4

64826-45-5 | 1,3-Dimethyl-2-oxo-2,3-dihydro-1h-benzoimidazole-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$208.00   $145.00
- +
1g
95%
in stock  
$420.00   $294.00
- +
5g
95%
in stock  
$1,160.00   $812.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0036Z4
Chemical Name:
1,3-Dimethyl-2-oxo-2,3-dihydro-1h-benzoimidazole-5-carboxylic acid
CAS Number:
64826-45-5
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD03721869
SMILES:
OC(=O)c1ccc2c(c1)n(C)c(=O)n2C
Properties
Properties
 
Form:
Solid  
MP:
275℃  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
305  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2004,vol.14,p.919-923

[1]EuropeanJournalofMedicinalChemistry,2014,vol.82,p.521-535

174561-02-5    64826-45-5   
N-((1-(4-fluorobenzyl)piperidin-4-yl)methyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzodimidazole-5-carboxamide 

[1]Mo,Jun;Chen,Tingkai;Yang,Hongyu;Guo,Yan;Li,Qi;Qiao,Yuting;Lin,Hongzhi;Feng,Feng;Liu,Wenyuan;Chen,Yao;Liu,Zongliang;Sun,Haopeng[JournalofEnzymeInhibitionandMedicinalChemistry,2020,vol.35,#1,p.330-343]

[1]CurrentPatentAssignee:THEROCKEFELLERUNIVERSITY;KHANTANWEER;STAMFORDANDREW;BRIDGEMEDICINES;MILLERMICHAEL-WO2021/127166,2021,A1

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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SDS
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Tags:64826-45-5 Molecular Formula|64826-45-5 MDL|64826-45-5 SMILES|64826-45-5 1,3-Dimethyl-2-oxo-2,3-dihydro-1h-benzoimidazole-5-carboxylic acid
Catalog No.: AA0036Z4
64826-45-5,MFCD03721869
64826-45-5 | 1,3-Dimethyl-2-oxo-2,3-dihydro-1h-benzoimidazole-5-carboxylic acid
Pack Size： 250mg
Purity： 95%
in stock
$208.00 $145.00
Pack Size： 1g
Purity： 95%
in stock
$420.00 $294.00
Pack Size： 5g
Purity： 95%
in stock
$1,160.00 $812.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0036Z4
Chemical Name: 1,3-Dimethyl-2-oxo-2,3-dihydro-1h-benzoimidazole-5-carboxylic acid
CAS Number: 64826-45-5
Molecular Formula: C10H10N2O3
Molecular Weight: 206.1980
MDL Number: MFCD03721869
SMILES: OC(=O)c1ccc2c(c1)n(C)c(=O)n2C
Properties
Form: Solid  
MP: 275℃  
Storage: Room Temperature;  
Complexity: 305  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
64826-45-5    53439-88-6 

[1]BioorganicandMedicinalChemistryLetters,2004,vol.14,p.919-923

64826-45-5    883535-89-5    1616960-95-2 

[1]EuropeanJournalofMedicinalChemistry,2014,vol.82,p.521-535

174561-02-5    64826-45-5   
N-((1-(4-fluorobenzyl)piperidin-4-yl)methyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzodimidazole-5-carboxamide 

[1]Mo,Jun;Chen,Tingkai;Yang,Hongyu;Guo,Yan;Li,Qi;Qiao,Yuting;Lin,Hongzhi;Feng,Feng;Liu,Wenyuan;Chen,Yao;Liu,Zongliang;Sun,Haopeng[JournalofEnzymeInhibitionandMedicinalChemistry,2020,vol.35,#1,p.330-343]

396652-38-3    64826-45-5 

[1]CurrentPatentAssignee:THEROCKEFELLERUNIVERSITY;KHANTANWEER;STAMFORDANDREW;BRIDGEMEDICINES;MILLERMICHAEL-WO2021/127166,2021,A1

Literature fold

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 Cytology20060501

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