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1538566-78-7
Catalog No.:AA01FOLF

1538566-78-7 | 6,7-bis(3-methoxyphenyl)-2-sulfanylpteridin-4-ol

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Technical Information
Catalog Number:
AA01FOLF
Chemical Name:
6,7-bis(3-methoxyphenyl)-2-sulfanylpteridin-4-ol
CAS Number:
1538566-78-7
Molecular Formula:
C20H16N4O3S
Molecular Weight:
392.4310
SMILES:
COC1=CC=CC(=C1)C2=NC3=C(NC(=S)NC3=O)N=C2C4=CC(=CC=C4)OC
Properties
Computed Properties
 
Complexity:
592  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
2.8  

Literature

Title: Discovery of HIV-1 integrase inhibitors: pharmacophore mapping, virtual screening, molecular docking, synthesis, and biological evaluation.

Journal: Chemical biology & drug design 20140201

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Tags:1538566-78-7 Molecular Formula|1538566-78-7 MDL|1538566-78-7 SMILES|1538566-78-7 6,7-bis(3-methoxyphenyl)-2-sulfanylpteridin-4-ol