(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide

C17H19NO6S — CID 71745325

IUPAC(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(O)cc2OC)cc1
InChIInChI=1S/C17H19NO6S/c1-22-14-6-4-12(5-7-14)18-25(20,21)9-8-15-16(23-2)10-13(19)11-17(15)24-3/h4-11,18-19H,1-3H3/b9-8+
InChIKeyFQRCHKYZKFPUOF-CMDGGOBGSA-N
MW365.41 g/mol
LogP2.83
Rot. Bonds7

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

(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide (PubChem CID 71745325) has the molecular formula C17H19NO6S and a molecular weight of 365.41 g/mol. Its IUPAC name is (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
PubChem CID71745325
Molecular FormulaC17H19NO6S
Molecular Weight365.41 g/mol
Exact Mass365.09
IUPAC Name(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(O)cc2OC)cc1
InChIInChI=1S/C17H19NO6S/c1-22-14-6-4-12(5-7-14)18-25(20,21)9-8-15-16(23-2)10-13(19)11-17(15)24-3/h4-11,18-19H,1-3H3/b9-8+
InChIKeyFQRCHKYZKFPUOF-CMDGGOBGSA-N
XLogP2.83
TPSA94.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
CID 71745323
(E)-2-(2,4-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
CID 71745322
(E)-N-(4-methoxyphenyl)prop-1-ene-1-sulfonamide
CID 70401574
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)ethenesulfonamide
CID 70038153
2-[2-methoxy-5-[2-(2,4,6-trimethoxyphenyl)ethenylsulfonylamino]anilino]acetic acid
CID 66810663
[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylamino]phenyl] 2,2,2-trifluoroacetate
CID 67102628
[2-[2-methoxy-5-[2-(2,4,6-trimethoxyphenyl)ethenylsulfonylamino]anilino]-2-oxoethyl] acetate
CID 67319141
2-chloro-N-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylamino]phenyl]acetamide
CID 10151889
3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylamino]anilino]-3-oxopropanoic acid
CID 10310996
N-(2-amino-4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
CID 67317738
2,2-difluoro-3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylamino]phenoxy]-3-oxopropanoic acid
CID 67102910

Frequently Asked Questions

What is the IUPAC name of (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The IUPAC name of (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide (CID 71745325) is (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide.
What is the SMILES notation for (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The canonical SMILES for (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide is COc1ccc(NS(=O)(=O)/C=C/c2c(OC)cc(O)cc2OC)cc1.
What is the InChIKey of (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The InChIKey is FQRCHKYZKFPUOF-CMDGGOBGSA-N. The full InChI is InChI=1S/C17H19NO6S/c1-22-14-6-4-12(5-7-14)18-25(20,21)9-8-15-16(23-2)10-13(19)11-17(15)24-3/h4-11,18-19H,1-3H3/b9-8+.
What are the key properties of (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide has a molecular weight of 365.41 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide is sourced from PubChem (CID 71745325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).