21585-16-0,MFCD00223744
Catalog No.:AA00BQKZ

21585-16-0 | 2,3-dihydro-5-(2-hydroxyethyl)-6-methyl-2-thioxo-1H-pyrimidin-4-one

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Purity
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1mg
>95%
1 week  
$299.00   $209.00
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5mg
>95%
1 week  
$319.00   $223.00
- +
500mg
>95%
1 week  
$339.00   $238.00
- +
1g
>95%
1 week  
$414.00   $290.00
- +
5g
>95%
1 week  
$813.00   $569.00
- +
10g
>95%
1 week  
$1,212.00   $848.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BQKZ
Chemical Name:
2,3-dihydro-5-(2-hydroxyethyl)-6-methyl-2-thioxo-1H-pyrimidin-4-one
CAS Number:
21585-16-0
Molecular Formula:
C7H10N2O2S
Molecular Weight:
186.2315
MDL Number:
MFCD00223744
SMILES:
OCCc1c(C)nc([nH]c1=O)S
NSC Number:
149870
Properties
Computed Properties
 
Complexity:
260  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.4  

Downstream Synthesis Route

[1]Patent:US2006/122206,2006,A1.Locationinpatent:Page/Pagecolumn4

[2]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

[1]Patent:US2006/122206,2006,A1.Locationinpatent:Page/Pagecolumn4

[2]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,8    Chem.Abstr.,1958,p.20183

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,8    Chem.Abstr.,1958,p.20183

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
Related Products of 21585-16-0
Tags:21585-16-0 Molecular Formula|21585-16-0 MDL|21585-16-0 SMILES|21585-16-0 2,3-dihydro-5-(2-hydroxyethyl)-6-methyl-2-thioxo-1H-pyrimidin-4-one
Catalog No.: AA00BQKZ
21585-16-0,MFCD00223744
21585-16-0 | 2,3-dihydro-5-(2-hydroxyethyl)-6-methyl-2-thioxo-1H-pyrimidin-4-one
Pack Size: 1mg
Purity: >95%
1 week
$299.00 $209.00
Pack Size: 5mg
Purity: >95%
1 week
$319.00 $223.00
Pack Size: 500mg
Purity: >95%
1 week
$339.00 $238.00
Pack Size: 1g
Purity: >95%
1 week
$414.00 $290.00
Pack Size: 5g
Purity: >95%
1 week
$813.00 $569.00
Pack Size: 10g
Purity: >95%
1 week
$1,212.00 $848.00
Quantity
- +
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Technical Information
Catalog Number: AA00BQKZ
Chemical Name: 2,3-dihydro-5-(2-hydroxyethyl)-6-methyl-2-thioxo-1H-pyrimidin-4-one
CAS Number: 21585-16-0
Molecular Formula: C7H10N2O2S
Molecular Weight: 186.2315
MDL Number: MFCD00223744
SMILES: OCCc1c(C)nc([nH]c1=O)S
NSC Number: 149870
Properties
Complexity: 260  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.4  
Downstream Synthesis Route
517-23-7    17356-08-0    21585-16-0 

[1]Patent:US2006/122206,2006,A1.Locationinpatent:Page/Pagecolumn4

[2]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

21585-16-0    74-88-4    98489-83-9 

[1]Patent:US2006/122206,2006,A1.Locationinpatent:Page/Pagecolumn4

[2]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

21585-16-0    89943-37-3 

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,8    Chem.Abstr.,1958,p.20183

21585-16-0    23935-66-2 

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,8    Chem.Abstr.,1958,p.20183

86351-01-1    17356-08-0    21585-16-0 

[1]Tanabeseiyakukenkyunenpo=AnnualreportofGoheiTanabeCo.,1958,vol.3,p.4,7    Chem.Abstr.,1958,p.20183

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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