bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine

C23H18N2O3 — CID 139055186

IUPACbis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine
SMILESO=C(c1ccc(O)cc1)c1ccc(O)cc1.c1cc(-c2ccncc2)ccn1
InChIInChI=1S/C13H10O3.C10H8N2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8,14-15H;1-8H
InChIKeyJDLHRBSFOAJDME-UHFFFAOYSA-N
MW370.41 g/mol
LogP4.47
Rot. Bonds3

About bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine

bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine (PubChem CID 139055186) has the molecular formula C23H18N2O3 and a molecular weight of 370.41 g/mol. Its IUPAC name is bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine.

Molecular Properties

Compound Namebis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine
PubChem CID139055186
Molecular FormulaC23H18N2O3
Molecular Weight370.41 g/mol
Exact Mass370.13
IUPAC Namebis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine
SMILESO=C(c1ccc(O)cc1)c1ccc(O)cc1.c1cc(-c2ccncc2)ccn1
InChIInChI=1S/C13H10O3.C10H8N2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8,14-15H;1-8H
InChIKeyJDLHRBSFOAJDME-UHFFFAOYSA-N
XLogP4.47
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 128018
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CA standard inhibitor, 2
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(E)-1-(3-hydroxyphenyl)-3-pyridin-3-ylprop-2-en-1-one
CID 16304855
N-[1-[(4-hydroxyphenyl)methyl]piperidin-4-yl]-4-pentyl-N-[(4-pyridin-3-ylphenyl)methyl]benzamide
CID 10302679
3'-hydroxy-N-[4-(3-pyridinyl)butyl][1,1'-biphenyl]-4-carboxamide
CID 14570085
5-Hydroxy-2-pyridin-4-ylmethylene-3,4-dihydro-2H-naphthalen-1-one
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Frequently Asked Questions

What is the IUPAC name of bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine?
The IUPAC name of bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine (CID 139055186) is bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine.
What is the SMILES notation for bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine?
The canonical SMILES for bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine is O=C(c1ccc(O)cc1)c1ccc(O)cc1.c1cc(-c2ccncc2)ccn1.
What is the InChIKey of bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine?
The InChIKey is JDLHRBSFOAJDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O3.C10H8N2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8,14-15H;1-8H.
What are the key properties of bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine?
bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine has a molecular weight of 370.41 g/mol, XLogP of 4.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-hydroxyphenyl)methanone;4-pyridin-4-ylpyridine is sourced from PubChem (CID 139055186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).