3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide

C24H25ClN2O5S — CID 2712878

IUPAC3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide
SMILESCCN(Cc1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2ccc(OC)c(Cl)c2)ccc1OC
InChIInChI=1S/C24H25ClN2O5S/c1-4-27(16-17-8-6-5-7-9-17)33(29,30)23-14-18(10-12-22(23)32-3)24(28)26-19-11-13-21(31-2)20(25)15-19/h5-15H,4,16H2,1-3H3,(H,26,28)
InChIKeyGMFBMQPOCBJDJA-UHFFFAOYSA-N
MW488.99 g/mol
LogP4.82
Rot. Bonds9

About 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide

3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide (PubChem CID 2712878) has the molecular formula C24H25ClN2O5S and a molecular weight of 488.99 g/mol. Its IUPAC name is 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide
PubChem CID2712878
Molecular FormulaC24H25ClN2O5S
Molecular Weight488.99 g/mol
Exact Mass488.12
IUPAC Name3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide
SMILESCCN(Cc1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2ccc(OC)c(Cl)c2)ccc1OC
InChIInChI=1S/C24H25ClN2O5S/c1-4-27(16-17-8-6-5-7-9-17)33(29,30)23-14-18(10-12-22(23)32-3)24(28)26-19-11-13-21(31-2)20(25)15-19/h5-15H,4,16H2,1-3H3,(H,26,28)
InChIKeyGMFBMQPOCBJDJA-UHFFFAOYSA-N
XLogP4.82
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.99
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 45374065
N-benzyl-N-ethyl-5-[[(4-ethylbenzoyl)amino]carbamoyl]-2-methoxybenzenesulfonamide
CID 4789084
3-[benzyl(ethyl)sulfamoyl]-N-(2,4-difluorophenyl)-4-methoxybenzamide
CID 2678829
3-[benzyl(ethyl)sulfamoyl]-N-(3-chlorophenyl)-4-fluorobenzamide
CID 4229430
3-chloro-N-[4-(diethylsulfamoyl)phenyl]-4-methoxybenzamide
CID 100560021
N-(2-benzylphenyl)-3-(diethylsulfamoyl)-4-methoxybenzamide
CID 26880143
N-(1-benzyl-1,2,4-triazol-3-yl)-3-(diethylsulfamoyl)-4-methoxybenzamide
CID 55856009
N-(2-benzyl-5-methylpyrazol-3-yl)-3-(diethylsulfamoyl)-4-methoxybenzamide
CID 55550889
3-(diethylsulfamoyl)-N-(2-ethylsulfonylphenyl)-4-methoxybenzamide
CID 55613417
2-[benzyl(methyl)amino]-N-(3-chloro-4-methoxyphenyl)pyrimidine-5-carboxamide
CID 109256823
N-(3-chloro-4-methoxyphenyl)-4-ethylbenzamide
CID 2540642
N-(3-chloro-4-cyanophenyl)-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 55339628

Frequently Asked Questions

What is the IUPAC name of 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide?
The IUPAC name of 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide (CID 2712878) is 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide?
The canonical SMILES for 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide is CCN(Cc1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2ccc(OC)c(Cl)c2)ccc1OC.
What is the InChIKey of 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide?
The InChIKey is GMFBMQPOCBJDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25ClN2O5S/c1-4-27(16-17-8-6-5-7-9-17)33(29,30)23-14-18(10-12-22(23)32-3)24(28)26-19-11-13-21(31-2)20(25)15-19/h5-15H,4,16H2,1-3H3,(H,26,28).
What are the key properties of 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide?
3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide has a molecular weight of 488.99 g/mol, XLogP of 4.82, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzyl(ethyl)sulfamoyl]-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 2712878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).