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134790-40-2,MFCD12031366
Catalog No.:AA00701C

134790-40-2 | 1'-Epi Gemcitabine 3',5'-Dibenzoate

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00701C
Chemical Name:
1'-Epi Gemcitabine 3',5'-Dibenzoate
CAS Number:
134790-40-2
Molecular Formula:
C23H19F2N3O6
Molecular Weight:
471.4103
MDL Number:
MFCD12031366
SMILES:
Nc1ccn(c(=O)n1)[C@@H]1O[C@@H]([C@@H](C1(F)F)OC(=O)c1ccccc1)COC(=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
852  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Literature
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SDS
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Tags:134790-40-2 Molecular Formula|134790-40-2 MDL|134790-40-2 SMILES|134790-40-2 1'-Epi Gemcitabine 3',5'-Dibenzoate
Catalog No.: AA00701C
134790-40-2,MFCD12031366
134790-40-2 | 1'-Epi Gemcitabine 3',5'-Dibenzoate
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA00701C
Chemical Name: 1'-Epi Gemcitabine 3',5'-Dibenzoate
CAS Number: 134790-40-2
Molecular Formula: C23H19F2N3O6
Molecular Weight: 471.4103
MDL Number: MFCD12031366
SMILES: Nc1ccn(c(=O)n1)[C@@H]1O[C@@H]([C@@H](C1(F)F)OC(=O)c1ccccc1)COC(=O)c1ccccc1
Properties
Complexity: 852  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 3  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 34  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
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