(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide

C18H21NO6S — CID 71745324

IUPAC(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(OC)cc2OC)cc1
InChIInChI=1S/C18H21NO6S/c1-22-14-7-5-13(6-8-14)19-26(20,21)10-9-16-17(24-3)11-15(23-2)12-18(16)25-4/h5-12,19H,1-4H3/b10-9+
InChIKeyCNXODVDGIBSDFK-MDZDMXLPSA-N
MW379.43 g/mol
LogP3.13
Rot. Bonds8

About (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide

(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide (PubChem CID 71745324) has the molecular formula C18H21NO6S and a molecular weight of 379.43 g/mol. Its IUPAC name is (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
PubChem CID71745324
Molecular FormulaC18H21NO6S
Molecular Weight379.43 g/mol
Exact Mass379.11
IUPAC Name(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(OC)cc2OC)cc1
InChIInChI=1S/C18H21NO6S/c1-22-14-7-5-13(6-8-14)19-26(20,21)10-9-16-17(24-3)11-15(23-2)12-18(16)25-4/h5-12,19H,1-4H3/b10-9+
InChIKeyCNXODVDGIBSDFK-MDZDMXLPSA-N
XLogP3.13
TPSA83.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(E)-2-methoxy-5-(((2,4,6-trimethoxystyryl)sulfonyl)methyl)aniline
CID 11486204
(E)-N-(3-Amino-4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
CID 10309597
2,4-Dimethoxy-4''-amino-trans-stilbene
CID 49799655
N-(4-phenylmethoxyphenyl)methanesulfonamide
CID 669037
2-bromo-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]aniline
CID 11374107
(E)-N-(3-hydroxy-4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
CID 11486259
2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfanylmethyl]aniline
CID 11996140
2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfinylmethyl]aniline
CID 11996431
(1E)-N-(4-Methoxy-3-nitrophenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
CID 67318854
2,4-Dimethoxy-3''-amino-trans-stilbene
CID 49799639
(E)-N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)ethenesulfonamide
CID 9967624
5-[[(E)-2-(2,4-dimethoxyphenyl)ethenyl]sulfonylmethyl]-2-methoxyaniline
CID 54578764

Frequently Asked Questions

What is the IUPAC name of (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide?
The IUPAC name of (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide (CID 71745324) is (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide.
What is the SMILES notation for (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide?
The canonical SMILES for (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide is COc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(OC)cc2OC)cc1.
What is the InChIKey of (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide?
The InChIKey is CNXODVDGIBSDFK-MDZDMXLPSA-N. The full InChI is InChI=1S/C18H21NO6S/c1-22-14-7-5-13(6-8-14)19-26(20,21)10-9-16-17(24-3)11-15(23-2)12-18(16)25-4/h5-12,19H,1-4H3/b10-9+.
What are the key properties of (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide?
(E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide has a molecular weight of 379.43 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide is sourced from PubChem (CID 71745324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).