[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone

C26H17FO4 — CID 139890668

IUPAC[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone
SMILESO=C(c1cccc(O)c1)c1ccccc1Oc1ccccc1C(=O)c1cccc(F)c1
InChIInChI=1S/C26H17FO4/c27-19-9-5-7-17(15-19)25(29)21-11-1-3-13-23(21)31-24-14-4-2-12-22(24)26(30)18-8-6-10-20(28)16-18/h1-16,28H
InChIKeyRFXBDLRUUZETST-UHFFFAOYSA-N
MW412.42 g/mol
LogP5.79
Rot. Bonds6

About [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone

[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone (PubChem CID 139890668) has the molecular formula C26H17FO4 and a molecular weight of 412.42 g/mol. Its IUPAC name is [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone
PubChem CID139890668
Molecular FormulaC26H17FO4
Molecular Weight412.42 g/mol
Exact Mass412.11
IUPAC Name[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone
SMILESO=C(c1cccc(O)c1)c1ccccc1Oc1ccccc1C(=O)c1cccc(F)c1
InChIInChI=1S/C26H17FO4/c27-19-9-5-7-17(15-19)25(29)21-11-1-3-13-23(21)31-24-14-4-2-12-22(24)26(30)18-8-6-10-20(28)16-18/h1-16,28H
InChIKeyRFXBDLRUUZETST-UHFFFAOYSA-N
XLogP5.79
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.42
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-fluorophenyl)-[2-(2-methoxyethoxy)phenyl]methanone
CID 104659113
(2-amino-4-fluorophenyl)-(3-hydroxyphenyl)methanone
CID 105489015
(5-fluoro-2-methoxyphenyl)-(3-fluorophenyl)methanone
CID 43339656
(2,5-difluorophenyl)-(3-fluorophenyl)methanone
CID 43159843
2-(3-fluorobenzoyl)benzaldehyde
CID 175472655
(3-hydroxyphenyl)-(2-methylphenyl)methanone
CID 68613493
[4-fluoro-2-(3-hydroxybenzoyl)oxyphenyl] 3-hydroxybenzoate
CID 46884130
(3-fluorophenyl) 3-hydroxybenzoate
CID 174105662
(2-phenoxyphenyl)-phenylmethanone
CID 10802273
[2-(2-bromophenoxy)phenyl]-phenylmethanone
CID 70097851
[2-(2-methoxyphenoxy)phenyl]-phenylmethanone
CID 157433245
2-fluoro-3-(3-fluorobenzoyl)benzonitrile
CID 174421745

Frequently Asked Questions

What is the IUPAC name of [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone?
The IUPAC name of [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone (CID 139890668) is [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone.
What is the SMILES notation for [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone?
The canonical SMILES for [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone is O=C(c1cccc(O)c1)c1ccccc1Oc1ccccc1C(=O)c1cccc(F)c1.
What is the InChIKey of [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone?
The InChIKey is RFXBDLRUUZETST-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17FO4/c27-19-9-5-7-17(15-19)25(29)21-11-1-3-13-23(21)31-24-14-4-2-12-22(24)26(30)18-8-6-10-20(28)16-18/h1-16,28H.
What are the key properties of [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone?
[2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone has a molecular weight of 412.42 g/mol, XLogP of 5.79, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(3-fluorobenzoyl)phenoxy]phenyl]-(3-hydroxyphenyl)methanone is sourced from PubChem (CID 139890668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).