4-[Hydroxy(6-phenylthieno[2,3-d]pyrimidin-4-yl)methyl]benzonitrile

Base Information

• Chemical Name: 4-[Hydroxy(6-phenylthieno[2,3-d]pyrimidin-4-yl)methyl]benzonitrile
• CAS No.: 718615-98-6
• Molecular Formula: C20H13N3OS
• DSSTox Substance ID: DTXSID101166060
• Nikkaji Number: J2.062.320I

Synonyms:DTXSID101166060;718615-98-6;4-[Hydroxy(6-phenylthieno[2,3-d]pyrimidin-4-yl)methyl]benzonitrile

Chemical Property of 4-[Hydroxy(6-phenylthieno[2,3-d]pyrimidin-4-yl)methyl]benzonitrile

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 343.07793322
• Heavy Atom Count: 25
• Complexity: 492

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Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)C(C4=CC=C(C=C4)C#N)O

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