[2-(benzenesulfonyl)-1-phenylethenyl]benzene

C20H16O2S — CID 822356

IUPAC[2-(benzenesulfonyl)-1-phenylethenyl]benzene
SMILESO=S(=O)(C=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H16O2S/c21-23(22,19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-16H
InChIKeyJGHGEBHNSZDBKF-UHFFFAOYSA-N
MW320.41 g/mol
LogP4.55
Rot. Bonds4

About [2-(benzenesulfonyl)-1-phenylethenyl]benzene

[2-(benzenesulfonyl)-1-phenylethenyl]benzene (PubChem CID 822356) has the molecular formula C20H16O2S and a molecular weight of 320.41 g/mol. Its IUPAC name is [2-(benzenesulfonyl)-1-phenylethenyl]benzene.

Molecular Properties

Compound Name[2-(benzenesulfonyl)-1-phenylethenyl]benzene
PubChem CID822356
Molecular FormulaC20H16O2S
Molecular Weight320.41 g/mol
Exact Mass320.09
IUPAC Name[2-(benzenesulfonyl)-1-phenylethenyl]benzene
SMILESO=S(=O)(C=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H16O2S/c21-23(22,19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-16H
InChIKeyJGHGEBHNSZDBKF-UHFFFAOYSA-N
XLogP4.55
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-[(Z)-2-(4-methylphenyl)sulfonyl-1-phenylethenyl]benzene
CID 102129637
2-(benzenesulfonyl)ethene-1,1-diamine
CID 21311523
(E)-1-(benzenesulfonyl)prop-1-en-2-ol
CID 118410381
2-chloroprop-1-enylsulfonylbenzene
CID 71326207
N-[(Z)-2-(benzenesulfonyl)-1-phenylethenyl]acetamide
CID 162400578
(E)-N-methyl-2-(4-methylphenyl)sulfonyl-1-phenylethenamine
CID 24972823
2-methyl-3-[(Z)-2-(4-methylphenyl)sulfonyl-1-phenylethenyl]-1H-indole
CID 101497449
[(Z)-2-(benzenesulfonyl)-1-prop-2-ynoxyethenyl]benzene
CID 101096056
1-methyl-4-[(Z)-2-phenyl-2-phenyltellanylethenyl]sulfonylbenzene
CID 10671713
[(1E)-2-bromo-3-methylbuta-1,3-dienyl]sulfonylbenzene
CID 102324021
(113C)ethenylsulfonylbenzene
CID 66995821
[(Z)-1-(benzenesulfonyl)-5-methoxypent-1-en-3-yn-2-yl]benzene
CID 10903050

Frequently Asked Questions

What is the IUPAC name of [2-(benzenesulfonyl)-1-phenylethenyl]benzene?
The IUPAC name of [2-(benzenesulfonyl)-1-phenylethenyl]benzene (CID 822356) is [2-(benzenesulfonyl)-1-phenylethenyl]benzene.
What is the SMILES notation for [2-(benzenesulfonyl)-1-phenylethenyl]benzene?
The canonical SMILES for [2-(benzenesulfonyl)-1-phenylethenyl]benzene is O=S(=O)(C=C(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of [2-(benzenesulfonyl)-1-phenylethenyl]benzene?
The InChIKey is JGHGEBHNSZDBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O2S/c21-23(22,19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-16H.
What are the key properties of [2-(benzenesulfonyl)-1-phenylethenyl]benzene?
[2-(benzenesulfonyl)-1-phenylethenyl]benzene has a molecular weight of 320.41 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(benzenesulfonyl)-1-phenylethenyl]benzene is sourced from PubChem (CID 822356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).