(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone

C25H15BrO2 — CID 66669293

IUPAC(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone
SMILESO=C(c1ccc(Br)cc1)c1cccc(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C25H15BrO2/c26-19-13-11-16(12-14-19)24(27)18-6-3-5-17(15-18)20-8-4-9-22-21-7-1-2-10-23(21)28-25(20)22/h1-15H
InChIKeyRBELLCUMYIPBMK-UHFFFAOYSA-N
MW427.30 g/mol
LogP7.25
Rot. Bonds3

About (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone

(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone (PubChem CID 66669293) has the molecular formula C25H15BrO2 and a molecular weight of 427.30 g/mol. Its IUPAC name is (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone.

Molecular Properties

Compound Name(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone
PubChem CID66669293
Molecular FormulaC25H15BrO2
Molecular Weight427.30 g/mol
Exact Mass426.03
IUPAC Name(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone
SMILESO=C(c1ccc(Br)cc1)c1cccc(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C25H15BrO2/c26-19-13-11-16(12-14-19)24(27)18-6-3-5-17(15-18)20-8-4-9-22-21-7-1-2-10-23(21)28-25(20)22/h1-15H
InChIKeyRBELLCUMYIPBMK-UHFFFAOYSA-N
XLogP7.25
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.30
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-bromophenyl)dibenzofuran
CID 59022098
(4-dibenzofuran-4-ylphenyl)-(9,9'-spirobi[fluorene]-2-yl)methanone
CID 59133482
4-(3-bromo-5-dibenzofuran-4-ylphenyl)dibenzofuran;methane
CID 142380453
4-[3-bromo-5-(3,5-diphenylphenyl)phenyl]dibenzofuran
CID 142380750
1-[5-bromo-2-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]ethanone
CID 142604922
5-bromo-2-dibenzofuran-4-ylbenzoic acid
CID 122634670
2-(3-bromo-5-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 142752625
4-(3-dibenzofuran-4-yl-5-phenylphenyl)dibenzofuran
CID 122451689
[4-(dibenzofuran-2-carbonyl)phenyl]-dibenzofuran-2-ylmethanone
CID 71375763
4-bromo-6-phenyldibenzofuran;4-phenyldibenzofuran
CID 158212345
(3-dibenzofuran-4-ylphenyl)phosphane;hydrochloride
CID 118935396
(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran
CID 158166002

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone?
The IUPAC name of (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone (CID 66669293) is (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone.
What is the SMILES notation for (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone?
The canonical SMILES for (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone is O=C(c1ccc(Br)cc1)c1cccc(-c2cccc3c2oc2ccccc23)c1.
What is the InChIKey of (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone?
The InChIKey is RBELLCUMYIPBMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15BrO2/c26-19-13-11-16(12-14-19)24(27)18-6-3-5-17(15-18)20-8-4-9-22-21-7-1-2-10-23(21)28-25(20)22/h1-15H.
What are the key properties of (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone?
(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone has a molecular weight of 427.30 g/mol, XLogP of 7.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone is sourced from PubChem (CID 66669293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).