4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide

C15H15ClN2O5S — CID 26695102

IUPAC4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC
InChIInChI=1S/C15H15ClN2O5S/c1-22-12-6-4-10(8-13(12)23-2)18-15(19)9-3-5-11(16)14(7-9)24(17,20)21/h3-8H,1-2H3,(H,18,19)(H2,17,20,21)
InChIKeyPREDTORZXFRJSU-UHFFFAOYSA-N
MW370.81 g/mol
LogP2.26
Rot. Bonds5

About 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide

4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide (PubChem CID 26695102) has the molecular formula C15H15ClN2O5S and a molecular weight of 370.81 g/mol. Its IUPAC name is 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide
PubChem CID26695102
Molecular FormulaC15H15ClN2O5S
Molecular Weight370.81 g/mol
Exact Mass370.04
IUPAC Name4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC
InChIInChI=1S/C15H15ClN2O5S/c1-22-12-6-4-10(8-13(12)23-2)18-15(19)9-3-5-11(16)14(7-9)24(17,20)21/h3-8H,1-2H3,(H,18,19)(H2,17,20,21)
InChIKeyPREDTORZXFRJSU-UHFFFAOYSA-N
XLogP2.26
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.81
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dichlorophenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36859467
N-(4-tert-butylphenyl)-4-chloro-3-sulfamoylbenzamide
CID 9413612
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
4-chloro-N-(4-propan-2-ylphenyl)-3-sulfamoylbenzamide
CID 24641042
3,5-dichloro-N-(4-methoxy-3-sulfamoylphenyl)benzamide
CID 26929610
3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide
CID 107620662
N-(3,5-dimethylphenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36704961
4-chloro-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-sulfamoylbenzamide
CID 24635521
3-methoxy-N-(4-methyl-3-sulfamoylphenyl)-4-propan-2-yloxybenzamide
CID 46520822
N-(3-chloro-4-methoxyphenyl)-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 45374065
4-chloro-N-methyl-3-sulfamoylbenzamide
CID 60637185
N-(3-amino-4-methoxyphenyl)-3-bromo-4-chlorobenzamide
CID 107990051

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide?
The IUPAC name of 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide (CID 26695102) is 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide.
What is the SMILES notation for 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide?
The canonical SMILES for 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide is COc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC.
What is the InChIKey of 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide?
The InChIKey is PREDTORZXFRJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O5S/c1-22-12-6-4-10(8-13(12)23-2)18-15(19)9-3-5-11(16)14(7-9)24(17,20)21/h3-8H,1-2H3,(H,18,19)(H2,17,20,21).
What are the key properties of 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide?
4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide has a molecular weight of 370.81 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide is sourced from PubChem (CID 26695102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).