Home Other Building Blocks 1599432-18-4
1599432-18-4,MFCD30496724
Catalog No.:AA01DTQI

1599432-18-4 | Ibrutinib-biotin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
99%
1 week  
$1,241.00   $869.00
- +
10mg
99%
1 week  
$1,955.00   $1,369.00
- +
25mg
99%
1 week  
$3,860.00   $2,702.00
- +
50mg
99%
1 week  
$6,146.00   $4,302.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01DTQI
Chemical Name:
Ibrutinib-biotin
CAS Number:
1599432-18-4
Molecular Formula:
C56H80N12O9S
Molecular Weight:
1097.3744
MDL Number:
MFCD30496724
SMILES:
CN(C/C=C/C(=O)N1CCC[C@H](C1)n1nc(c2c1ncnc2N)c1ccc(cc1)Oc1ccccc1)CCCCNC(=O)CCCC(=O)NCCCOCCOCCOCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2
Properties
Computed Properties
 
Complexity:
1830  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
78  
Hydrogen Bond Acceptor Count:
15  
Hydrogen Bond Donor Count:
6  
Rotatable Bond Count:
35  
XLogP3:
3  

Literature

Title: Betty Y. CHANG, et al. Companion diagnostics for tec family kinase inhibitor therapy. WO 2014059368 A1.

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SDS
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Tags:1599432-18-4 Molecular Formula|1599432-18-4 MDL|1599432-18-4 SMILES|1599432-18-4 Ibrutinib-biotin