4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide

C19H17NO5S2 — CID 993467

IUPAC4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)N(c2ccc(OC)cc2)S(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H17NO5S2/c1-24-16-9-5-14(6-10-16)19(21)20(15-7-11-17(25-2)12-8-15)27(22,23)18-4-3-13-26-18/h3-13H,1-2H3
InChIKeyDWRSNQWISRGPGY-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.80
Rot. Bonds6

About 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide

4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide (PubChem CID 993467) has the molecular formula C19H17NO5S2 and a molecular weight of 403.48 g/mol. Its IUPAC name is 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide.

Molecular Properties

Compound Name4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide
PubChem CID993467
Molecular FormulaC19H17NO5S2
Molecular Weight403.48 g/mol
Exact Mass403.05
IUPAC Name4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)N(c2ccc(OC)cc2)S(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H17NO5S2/c1-24-16-9-5-14(6-10-16)19(21)20(15-7-11-17(25-2)12-8-15)27(22,23)18-4-3-13-26-18/h3-13H,1-2H3
InChIKeyDWRSNQWISRGPGY-UHFFFAOYSA-N
XLogP3.80
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methoxyphenyl)-4-methyl-N-thiophen-2-ylsulfonylbenzamide
CID 993466
[4-[acetyl(thiophen-2-ylsulfonyl)amino]phenyl] acetate
CID 754067
[4-[phenoxycarbonyl(thiophen-2-ylsulfonyl)amino]phenyl] phenyl carbonate
CID 2376152
N-(4-methoxyphenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100548025
N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-4-nitrobenzamide
CID 2907624
N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
CID 126615373
N-(benzenesulfonyl)-N-(4-methoxyphenyl)-3,5-dinitrobenzamide
CID 19210794
N-(4-chlorophenyl)sulfonyl-3-methoxy-N-(4-methoxyphenyl)benzamide
CID 19211456
N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
CID 19204610
ethyl 4-[methyl(thiophen-2-ylsulfonyl)amino]benzoate
CID 2989771
2-(4-methoxy-N-thiophen-2-ylsulfonylanilino)-N-(2-phenylphenyl)acetamide
CID 47004366
methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetate
CID 42982225

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide?
The IUPAC name of 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide (CID 993467) is 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide.
What is the SMILES notation for 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide?
The canonical SMILES for 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide is COc1ccc(C(=O)N(c2ccc(OC)cc2)S(=O)(=O)c2cccs2)cc1.
What is the InChIKey of 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide?
The InChIKey is DWRSNQWISRGPGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO5S2/c1-24-16-9-5-14(6-10-16)19(21)20(15-7-11-17(25-2)12-8-15)27(22,23)18-4-3-13-26-18/h3-13H,1-2H3.
What are the key properties of 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide?
4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide has a molecular weight of 403.48 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide is sourced from PubChem (CID 993467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).