[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene

C16H14O4S2 — CID 15531132

IUPAC[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene
SMILESO=S(=O)(/C=C/c1ccccc1)/C=C/S(=O)(=O)c1ccccc1
InChIInChI=1S/C16H14O4S2/c17-21(18,12-11-15-7-3-1-4-8-15)13-14-22(19,20)16-9-5-2-6-10-16/h1-14H/b12-11+,14-13+
InChIKeyCIKYJUNRCWSDIF-LDHFCIDVSA-N
MW334.42 g/mol
LogP3.02
Rot. Bonds5

About [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene

[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene (PubChem CID 15531132) has the molecular formula C16H14O4S2 and a molecular weight of 334.42 g/mol. Its IUPAC name is [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene.

Molecular Properties

Compound Name[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene
PubChem CID15531132
Molecular FormulaC16H14O4S2
Molecular Weight334.42 g/mol
Exact Mass334.03
IUPAC Name[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene
SMILESO=S(=O)(/C=C/c1ccccc1)/C=C/S(=O)(=O)c1ccccc1
InChIInChI=1S/C16H14O4S2/c17-21(18,12-11-15-7-3-1-4-8-15)13-14-22(19,20)16-9-5-2-6-10-16/h1-14H/b12-11+,14-13+
InChIKeyCIKYJUNRCWSDIF-LDHFCIDVSA-N
XLogP3.02
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene?
The IUPAC name of [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene (CID 15531132) is [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene.
What is the SMILES notation for [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene?
The canonical SMILES for [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene is O=S(=O)(/C=C/c1ccccc1)/C=C/S(=O)(=O)c1ccccc1.
What is the InChIKey of [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene?
The InChIKey is CIKYJUNRCWSDIF-LDHFCIDVSA-N. The full InChI is InChI=1S/C16H14O4S2/c17-21(18,12-11-15-7-3-1-4-8-15)13-14-22(19,20)16-9-5-2-6-10-16/h1-14H/b12-11+,14-13+.
What are the key properties of [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene?
[(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene has a molecular weight of 334.42 g/mol, XLogP of 3.02, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-[(E)-2-(benzenesulfonyl)ethenyl]sulfonylethenyl]benzene is sourced from PubChem (CID 15531132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).