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Home  > 4-[[(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)methyl]amino]benzoic acid

AB44800

7000-61-5 | 4-[[(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)methyl]amino]benzoic acid

Packsize Purity Availability Price Discounted Price    Quantity
250mg 95% in stock $1,208.00 $845.00 -   +

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Description
Catalog Number: AB44800
Chemical Name: 4-[[(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)methyl]amino]benzoic acid
CAS Number: 7000-61-5
Molecular Formula: C15H15N5O4
Molecular Weight: 329.3107
MDL Number: MFCD22495143
SMILES: OC(=O)c1ccc(cc1)NCc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C
NSC Number: 81750

 

Computed Properties
Complexity: 534  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 3  
Rotatable Bond Count: 4  
XLogP3: 0.7  

 

 

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