(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone

C26H17NO2 — CID 122208629

IUPAC(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)c1c(-c2ccccn2)oc2ccccc12
InChIInChI=1S/C26H17NO2/c28-25(20-15-13-19(14-16-20)18-8-2-1-3-9-18)24-21-10-4-5-12-23(21)29-26(24)22-11-6-7-17-27-22/h1-17H
InChIKeyOSHNMWOWTGSZDT-UHFFFAOYSA-N
MW375.43 g/mol
LogP6.39
Rot. Bonds4

About (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone

(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone (PubChem CID 122208629) has the molecular formula C26H17NO2 and a molecular weight of 375.43 g/mol. Its IUPAC name is (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone.

Molecular Properties

Compound Name(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone
PubChem CID122208629
Molecular FormulaC26H17NO2
Molecular Weight375.43 g/mol
Exact Mass375.13
IUPAC Name(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)c1c(-c2ccccn2)oc2ccccc12
InChIInChI=1S/C26H17NO2/c28-25(20-15-13-19(14-16-20)18-8-2-1-3-9-18)24-21-10-4-5-12-23(21)29-26(24)22-11-6-7-17-27-22/h1-17H
InChIKeyOSHNMWOWTGSZDT-UHFFFAOYSA-N
XLogP6.39
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.43
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxyphenyl)-(2-phenyl-1-benzofuran-3-yl)methanone
CID 6613416
phenyl-(4-phenylphenyl)methanone
CID 155775877
4-(4-dibenzofuran-2-ylphenyl)-6-phenyl-2-(4-pyridin-2-ylphenyl)pyrimidine
CID 130262632
(3-methoxyphenyl)-(2-phenyl-1-benzofuran-3-yl)methanone
CID 21435338
[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]-(4-methoxyphenyl)methanone
CID 54105837
[2-[4-[7-[benzyl(methyl)amino]heptoxy]phenyl]-1-benzofuran-3-yl]-(4-phenylphenyl)methanone
CID 71455057
3-benzoyl-4-phenylchromen-2-one
CID 629843
4-(3-dibenzofuran-2-yl-5-phenylphenyl)-6-(3,5-dipyridin-2-ylphenyl)-2-phenylpyrimidine
CID 171585229
2-dibenzofuran-3-yl-5-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-3,6-diphenylpyrazine
CID 156509413
phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum
CID 59538579
4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-phenyl-2-[4-(4-pyridin-2-ylphenyl)phenyl]pyrimidine
CID 130262495
3-(4-ethoxybenzoyl)-2-phenylchromen-4-one
CID 134910996

Frequently Asked Questions

What is the IUPAC name of (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone?
The IUPAC name of (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone (CID 122208629) is (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone.
What is the SMILES notation for (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone?
The canonical SMILES for (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone is O=C(c1ccc(-c2ccccc2)cc1)c1c(-c2ccccn2)oc2ccccc12.
What is the InChIKey of (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone?
The InChIKey is OSHNMWOWTGSZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17NO2/c28-25(20-15-13-19(14-16-20)18-8-2-1-3-9-18)24-21-10-4-5-12-23(21)29-26(24)22-11-6-7-17-27-22/h1-17H.
What are the key properties of (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone?
(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone has a molecular weight of 375.43 g/mol, XLogP of 6.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone is sourced from PubChem (CID 122208629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).