102772-66-7,MFCD21363485
Catalog No.:AA008WKP

102772-66-7 | 1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
2 weeks  
$735.00   $515.00
- +
25mg
2 weeks  
$2,164.00   $1,515.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Download SDS
Technical Information
Catalog Number:
AA008WKP
Chemical Name:
1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt
CAS Number:
102772-66-7
Molecular Formula:
C26H30N6O7S2
Molecular Weight:
602.6824
MDL Number:
MFCD21363485
SMILES:
O=C1[C@@H](NC(=O)/C(=N\OC(C(=O)OC(C)(C)C)(C)C)/c2csc(=N)[nH]2)[C@@H]2N1C(=C(CS2)C[n+]1ccccc1)C(=O)[O-]
Properties
Computed Properties
 
Complexity:
1130  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
41  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
10  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.8  

Literature
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SDS
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Tags:102772-66-7 Molecular Formula|102772-66-7 MDL|102772-66-7 SMILES|102772-66-7 1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt
Catalog No.: AA008WKP
102772-66-7,MFCD21363485
102772-66-7 | 1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt
Pack Size: 5mg
Purity:
2 weeks
$735.00 $515.00
Pack Size: 25mg
Purity:
2 weeks
$2,164.00 $1,515.00
Quantity
- +
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bulk Quotation Request
Technical Information
Catalog Number: AA008WKP
Chemical Name: 1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt
CAS Number: 102772-66-7
Molecular Formula: C26H30N6O7S2
Molecular Weight: 602.6824
MDL Number: MFCD21363485
SMILES: O=C1[C@@H](NC(=O)/C(=N\OC(C(=O)OC(C)(C)C)(C)C)/c2csc(=N)[nH]2)[C@@H]2N1C(=C(CS2)C[n+]1ccccc1)C(=O)[O-]
Properties
Complexity: 1130  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 41  
Hydrogen Bond Acceptor Count: 12  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 10  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.8  
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