N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide

C18H22N2O6S — CID 9106537

IUPACN-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)c(OC)c1
InChIInChI=1S/C18H22N2O6S/c1-20(2)27(22,23)17-10-12(6-9-15(17)25-4)19-18(21)14-8-7-13(24-3)11-16(14)26-5/h6-11H,1-5H3,(H,19,21)
InChIKeyZWDFZNNZVYUONA-UHFFFAOYSA-N
MW394.45 g/mol
LogP2.21
Rot. Bonds7

About N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide

N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide (PubChem CID 9106537) has the molecular formula C18H22N2O6S and a molecular weight of 394.45 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide
PubChem CID9106537
Molecular FormulaC18H22N2O6S
Molecular Weight394.45 g/mol
Exact Mass394.12
IUPAC NameN-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)c(OC)c1
InChIInChI=1S/C18H22N2O6S/c1-20(2)27(22,23)17-10-12(6-9-15(17)25-4)19-18(21)14-8-7-13(24-3)11-16(14)26-5/h6-11H,1-5H3,(H,19,21)
InChIKeyZWDFZNNZVYUONA-UHFFFAOYSA-N
XLogP2.21
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3,4-dimethoxybenzamide
CID 9106584
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-4-propan-2-ylbenzamide
CID 9106497
2-chloro-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-5-nitrobenzamide
CID 9106447
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3,3-dimethylbutanamide
CID 9109103
N-(3-chloro-4-methoxyphenyl)-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 45374065
2,5-dimethoxy-N-(4-methoxyphenyl)benzamide
CID 8574615
methyl 2-chloro-5-[[3-(dimethylsulfamoyl)-4-methoxybenzoyl]amino]benzoate
CID 55556618
5-bromo-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]pyridine-3-carboxamide
CID 9106525
N-[2-[[3-(dimethylsulfamoyl)-4-methoxyphenyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 30661239
2-methoxy-5-[(4-methoxyphenyl)sulfonylamino]-N,N-dimethylbenzenesulfonamide
CID 7586511
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]cyclobutanecarboxamide
CID 8849768
N-(4-ethoxyphenyl)-2,4-dimethoxybenzamide
CID 669318

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide (CID 9106537) is N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)c(OC)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide?
The InChIKey is ZWDFZNNZVYUONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O6S/c1-20(2)27(22,23)17-10-12(6-9-15(17)25-4)19-18(21)14-8-7-13(24-3)11-16(14)26-5/h6-11H,1-5H3,(H,19,21).
What are the key properties of N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide?
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide has a molecular weight of 394.45 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2,4-dimethoxybenzamide is sourced from PubChem (CID 9106537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).