N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide

C21H19NO5S — CID 19204610

IUPACN-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(N(C(=O)c2ccccc2OC)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19NO5S/c1-26-17-14-12-16(13-15-17)22(28(24,25)18-8-4-3-5-9-18)21(23)19-10-6-7-11-20(19)27-2/h3-15H,1-2H3
InChIKeyIODXEIMTTNXVDA-UHFFFAOYSA-N
MW397.45 g/mol
LogP3.74
Rot. Bonds6

About N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide

N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide (PubChem CID 19204610) has the molecular formula C21H19NO5S and a molecular weight of 397.45 g/mol. Its IUPAC name is N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
PubChem CID19204610
Molecular FormulaC21H19NO5S
Molecular Weight397.45 g/mol
Exact Mass397.10
IUPAC NameN-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(N(C(=O)c2ccccc2OC)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19NO5S/c1-26-17-14-12-16(13-15-17)22(28(24,25)18-8-4-3-5-9-18)21(23)19-10-6-7-11-20(19)27-2/h3-15H,1-2H3
InChIKeyIODXEIMTTNXVDA-UHFFFAOYSA-N
XLogP3.74
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.45
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(benzenesulfonyl)-N-(4-ethoxyphenyl)-2-methoxybenzamide
CID 19210850
2-methoxy-N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 1322535
N-(4-ethylphenyl)-2-methoxy-N-(4-methylphenyl)sulfonylbenzamide
CID 19210849
N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-2-(2-phenylethyl)benzamide
CID 19210204
N-(benzenesulfonyl)-2-bromo-3,4,5-trimethoxy-N-(4-methylphenyl)benzamide
CID 19211300
N-(benzenesulfonyl)-N-(4-methoxyphenyl)-3,5-dinitrobenzamide
CID 19210794
N-(benzenesulfonyl)-2-bromo-N-(4-methylphenyl)benzamide
CID 19210740
(E)-N-(benzenesulfonyl)-N,3-bis(4-methoxyphenyl)prop-2-enamide
CID 19211692
N-(benzenesulfonyl)-2-(2,3-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 19218157
N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methyl-3-nitrobenzamide
CID 19219283
(E)-N-(benzenesulfonyl)-3-(2-butoxyphenyl)-N-(4-methoxyphenyl)prop-2-enamide
CID 19219540
N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
CID 46022004

Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide?
The IUPAC name of N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide (CID 19204610) is N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide is COc1ccc(N(C(=O)c2ccccc2OC)S(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide?
The InChIKey is IODXEIMTTNXVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO5S/c1-26-17-14-12-16(13-15-17)22(28(24,25)18-8-4-3-5-9-18)21(23)19-10-6-7-11-20(19)27-2/h3-15H,1-2H3.
What are the key properties of N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide?
N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide has a molecular weight of 397.45 g/mol, XLogP of 3.74, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 19204610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).