4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide

C24H26N2O6S — CID 27258631

IUPAC4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc(OC)c1OC
InChIInChI=1S/C24H26N2O6S/c1-15-7-6-8-20(16(15)2)26-33(28,29)19-11-9-17(10-12-19)24(27)25-18-13-21(30-3)23(32-5)22(14-18)31-4/h6-14,26H,1-5H3,(H,25,27)
InChIKeyOVSDXYDYDXVEJL-UHFFFAOYSA-N
MW470.55 g/mol
LogP4.38
Rot. Bonds8

About 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide

4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide (PubChem CID 27258631) has the molecular formula C24H26N2O6S and a molecular weight of 470.55 g/mol. Its IUPAC name is 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide
PubChem CID27258631
Molecular FormulaC24H26N2O6S
Molecular Weight470.55 g/mol
Exact Mass470.15
IUPAC Name4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc(OC)c1OC
InChIInChI=1S/C24H26N2O6S/c1-15-7-6-8-20(16(15)2)26-33(28,29)19-11-9-17(10-12-19)24(27)25-18-13-21(30-3)23(32-5)22(14-18)31-4/h6-14,26H,1-5H3,(H,25,27)
InChIKeyOVSDXYDYDXVEJL-UHFFFAOYSA-N
XLogP4.38
TPSA102.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.55
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
CID 9411974
4-[(2-methoxyphenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26538003
4-(benzenesulfonamido)-N-(2,3-dimethylphenyl)benzamide
CID 1252770
N-[2-[(3,4,5-trimethoxyphenyl)sulfonylamino]phenyl]benzamide
CID 69347102
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-fluoro-2-methylphenyl)benzamide
CID 7908370
N-(2,3-dimethylphenyl)-4-[(3-methylphenyl)sulfamoyl]benzamide
CID 109061685
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide
CID 3692029
4-(butan-2-ylsulfamoyl)-N-(3,4,5-trimethoxyphenyl)benzamide
CID 46646956
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-ethyl-6-methylphenyl)benzamide
CID 112770782
4-(dimethylsulfamoyl)-N-(3,4,5-trimethoxyphenyl)benzamide
CID 1272637
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
3-[(2,3-dimethylphenyl)sulfamoyl]-N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 5131811

Frequently Asked Questions

What is the IUPAC name of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide?
The IUPAC name of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide (CID 27258631) is 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide.
What is the SMILES notation for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide?
The canonical SMILES for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide is COc1cc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc(OC)c1OC.
What is the InChIKey of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide?
The InChIKey is OVSDXYDYDXVEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O6S/c1-15-7-6-8-20(16(15)2)26-33(28,29)19-11-9-17(10-12-19)24(27)25-18-13-21(30-3)23(32-5)22(14-18)31-4/h6-14,26H,1-5H3,(H,25,27).
What are the key properties of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide?
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide has a molecular weight of 470.55 g/mol, XLogP of 4.38, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide is sourced from PubChem (CID 27258631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).