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Home  > 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylthio)butyl]-, (3S,4aS,8aS)-, methanesulfonate (1:1)

AA82169

159989-65-8 | 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylthio)butyl]-, (3S,4aS,8aS)-, methanesulfonate (1:1)

Packsize Purity Availability Price Discounted Price    Quantity
1mg 98% in stock $23.00 $17.00 -   +
5mg 98% in stock $51.00 $36.00 -   +
10mg 98% in stock $89.00 $63.00 -   +
25mg 98%(HPLC) in stock $168.00 $118.00 -   +
50mg 98%(HPLC) in stock $272.00 $191.00 -   +
100mg >97.0%(HPLC) in stock $445.00 $312.00 -   +
1000mg 98% by HPLC in stock $4,358.00 $3,051.00 -   +

*All products are for research use only and not intended for human or animal use.

*All prices are in USD.

Description
Catalog Number: AA82169
Chemical Name: 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylthio)butyl]-, (3S,4aS,8aS)-, methanesulfonate (1:1)
CAS Number: 159989-65-8
Molecular Formula: C33H49N3O7S2
Molecular Weight: 663.8881
MDL Number: MFCD00931436
SMILES: CS(=O)(=O)O.O[C@@H]([C@@H](NC(=O)c1cccc(c1C)O)CSc1ccccc1)CN1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
NSC Number: 722664

 

Computed Properties
Complexity: 922  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 5  
Heavy Atom Count: 45  
Hydrogen Bond Acceptor Count: 9  
Hydrogen Bond Donor Count: 5  
Rotatable Bond Count: 10  

 

 

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