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Home Deuterated Building Blocks 1313874-96-2
1313874-96-2,MFCD30747909
Catalog No.:AA009X5Z

1313874-96-2 | Afatinib-d6

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥99% deuterated forms (d1-d6)
in stock  
$415.00   $290.00
- +
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA009X5Z
Chemical Name:
Afatinib-d6
CAS Number:
1313874-96-2
Molecular Formula:
C24H19ClD6FN5O3
Molecular Weight:
491.9754
MDL Number:
MFCD30747909
SMILES:
O=C(Nc1cc2c(ncnc2cc1O[C@@H]1COCC1)Nc1ccc(c(c1)Cl)F)/C=C/CN(C([2H])([2H])[2H])C([2H])([2H])[2H]
Properties
Computed Properties
 
Complexity:
702  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
6  
Rotatable Bond Count:
8  
XLogP3:
3.6  

Literature

Title: Li D, et al. BIBW2992, an irreversible EGFR/HER2 inhibitor highly effective in preclinical lung cancer models. Oncogene. 2008 Aug 7;27(34):4702-11.

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SDS
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Tags:1313874-96-2 Molecular Formula|1313874-96-2 MDL|1313874-96-2 SMILES|1313874-96-2 Afatinib-d6