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Home Other Building Blocks 252198-49-5
252198-49-5,MFCD31630722
Catalog No.:AA00C1FB

252198-49-5 | TERTIAPIN-Q

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Purity
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Price(USD)
Quantity
  
1mg
≥95%
in stock  
$704.00   $493.00
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Technical Information
Catalog Number:
AA00C1FB
Chemical Name:
TERTIAPIN-Q
CAS Number:
252198-49-5
Molecular Formula:
C100H163N31O23S4
Molecular Weight:
2295.8181
MDL Number:
MFCD31630722
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N)CCCCN)NC(=O)CNC(=O)[C@@H]1CSSC[C@@H]2NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)CCCCN)Cc1c[nH]c3c1cccc3)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1N(C(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CC(=O)N)[C@H](CC)C)[C@H](CC)C)[C@H](CC)C)CCC1)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CC(C)C
Properties
Computed Properties
 
Complexity:
4840  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
21  
Heavy Atom Count:
158  
Hydrogen Bond Acceptor Count:
33  
Hydrogen Bond Donor Count:
29  
Rotatable Bond Count:
46  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-5.2  

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SDS
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Tags:252198-49-5 Molecular Formula|252198-49-5 MDL|252198-49-5 SMILES|252198-49-5 TERTIAPIN-Q