(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide

C16H17NO4S — CID 11996429

IUPAC(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(/C=C/S(=O)(=O)Nc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H17NO4S/c1-20-15-7-3-13(4-8-15)11-12-22(18,19)17-14-5-9-16(21-2)10-6-14/h3-12,17H,1-2H3/b12-11+
InChIKeyJWGZJPFPYVTQPZ-VAWYXSNFSA-N
MW319.38 g/mol
LogP3.12
Rot. Bonds6

About (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide

(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide (PubChem CID 11996429) has the molecular formula C16H17NO4S and a molecular weight of 319.38 g/mol. Its IUPAC name is (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide
PubChem CID11996429
Molecular FormulaC16H17NO4S
Molecular Weight319.38 g/mol
Exact Mass319.09
IUPAC Name(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(/C=C/S(=O)(=O)Nc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H17NO4S/c1-20-15-7-3-13(4-8-15)11-12-22(18,19)17-14-5-9-16(21-2)10-6-14/h3-12,17H,1-2H3/b12-11+
InChIKeyJWGZJPFPYVTQPZ-VAWYXSNFSA-N
XLogP3.12
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide?
The IUPAC name of (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide (CID 11996429) is (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide.
What is the SMILES notation for (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide?
The canonical SMILES for (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide is COc1ccc(/C=C/S(=O)(=O)Nc2ccc(OC)cc2)cc1.
What is the InChIKey of (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide?
The InChIKey is JWGZJPFPYVTQPZ-VAWYXSNFSA-N. The full InChI is InChI=1S/C16H17NO4S/c1-20-15-7-3-13(4-8-15)11-12-22(18,19)17-14-5-9-16(21-2)10-6-14/h3-12,17H,1-2H3/b12-11+.
What are the key properties of (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide?
(E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide has a molecular weight of 319.38 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,2-bis(4-methoxyphenyl)ethenesulfonamide is sourced from PubChem (CID 11996429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).