1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene

C18H13FO3S — CID 853558

IUPAC1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene
SMILESO=S(=O)(c1ccc(F)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C18H13FO3S/c19-14-6-10-17(11-7-14)23(20,21)18-12-8-16(9-13-18)22-15-4-2-1-3-5-15/h1-13H
InChIKeyPGVJWOQWIJCVBV-UHFFFAOYSA-N
MW328.36 g/mol
LogP4.45
Rot. Bonds4

About 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene

1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene (PubChem CID 853558) has the molecular formula C18H13FO3S and a molecular weight of 328.36 g/mol. Its IUPAC name is 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene.

Molecular Properties

Compound Name1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene
PubChem CID853558
Molecular FormulaC18H13FO3S
Molecular Weight328.36 g/mol
Exact Mass328.06
IUPAC Name1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene
SMILESO=S(=O)(c1ccc(F)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C18H13FO3S/c19-14-6-10-17(11-7-14)23(20,21)18-12-8-16(9-13-18)22-15-4-2-1-3-5-15/h1-13H
InChIKeyPGVJWOQWIJCVBV-UHFFFAOYSA-N
XLogP4.45
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.36
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(benzenesulfonyl)-4-[4-[4-[4-(benzenesulfonyl)phenoxy]phenyl]sulfonylphenoxy]benzene
CID 175665287
5-[4-(4-fluorophenyl)sulfonylphenoxy]benzene-1,3-diol
CID 101498559
1-fluoro-4-(4-phenoxyphenyl)benzene
CID 163618291
4-[4-[4-[4-[4-(4-aminophenoxy)phenoxy]phenyl]sulfonylphenoxy]phenoxy]aniline;benzenesulfonylbenzene
CID 158973912
2-[4-(benzenesulfonyl)phenoxy]-5-fluoropyrimidine
CID 166234271
[4-[4-[[4-[4-(4-fluorobenzoyl)phenoxy]phenyl]-diphenylmethyl]phenoxy]phenyl]-[4-[4-[4-[4-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonylphenoxy]phenyl]sulfonylphenoxy]phenyl]methanone
CID 59648946
4-[4-[4-(4-aminophenoxy)phenyl]sulfonylphenoxy]aniline;1,1'-biphenyl
CID 160996826
1-[4-(benzenesulfonyl)phenoxy]-4-[(2-methylpropan-2-yl)oxy]benzene
CID 155030070
4-[4-[4-[4-(4-phenylphenoxy)phenyl]sulfonylphenoxy]phenyl]phenol
CID 155639778
1-(2-methylpropyl)-4-[4-(4-phenoxyphenyl)sulfonylphenoxy]benzene
CID 139568524
4-[3-(4-fluorophenoxy)phenoxy]-N,N-dimethylbenzenesulfonamide
CID 141362712
[3-[4-[4-(3-benzoylphenoxy)phenyl]sulfonylphenoxy]phenyl]-phenylmethanone
CID 175364339

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene?
The IUPAC name of 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene (CID 853558) is 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene.
What is the SMILES notation for 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene?
The canonical SMILES for 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene is O=S(=O)(c1ccc(F)cc1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene?
The InChIKey is PGVJWOQWIJCVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FO3S/c19-14-6-10-17(11-7-14)23(20,21)18-12-8-16(9-13-18)22-15-4-2-1-3-5-15/h1-13H.
What are the key properties of 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene?
1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene has a molecular weight of 328.36 g/mol, XLogP of 4.45, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)sulfonyl-4-phenoxybenzene is sourced from PubChem (CID 853558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).