4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide

C14H14ClN3O5S — CID 25046045

IUPAC4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)n1
InChIInChI=1S/C14H14ClN3O5S/c1-22-12-6-5-10(14(18-12)23-2)17-13(19)8-3-4-9(15)11(7-8)24(16,20)21/h3-7H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyDBCZISVYKRRQHK-UHFFFAOYSA-N
MW371.80 g/mol
LogP1.65
Rot. Bonds5

About 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide

4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide (PubChem CID 25046045) has the molecular formula C14H14ClN3O5S and a molecular weight of 371.80 g/mol. Its IUPAC name is 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide
PubChem CID25046045
Molecular FormulaC14H14ClN3O5S
Molecular Weight371.80 g/mol
Exact Mass371.03
IUPAC Name4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)n1
InChIInChI=1S/C14H14ClN3O5S/c1-22-12-6-5-10(14(18-12)23-2)17-13(19)8-3-4-9(15)11(7-8)24(16,20)21/h3-7H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyDBCZISVYKRRQHK-UHFFFAOYSA-N
XLogP1.65
TPSA120.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.80
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-(3,4-dimethoxyphenyl)-3-sulfamoylbenzamide
CID 26695102
4-chloro-N-methyl-3-sulfamoylbenzamide
CID 60637185
N-(3,4-dichlorophenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36859467
N-(4-tert-butylphenyl)-4-chloro-3-sulfamoylbenzamide
CID 9413612
4-chloro-N-(4-propan-2-ylphenyl)-3-sulfamoylbenzamide
CID 24641042
N-(3-chloro-2-methylphenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36862429
4-chloro-N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 46525468
2-chloro-5-(dimethylaminocarbamoyl)benzenesulfonamide;hydrochloride
CID 174942395
N-(2-amino-4-methoxyphenyl)-3,4-dichlorobenzamide
CID 16777237
4-chloro-3-[(4-fluorophenyl)sulfamoyl]-N-(2-methoxy-3-pyridinyl)benzamide
CID 55869382
4-chloro-3-[(4-methoxybenzoyl)amino]benzenesulfonic acid
CID 139946899
4-chloro-N-[1-(2,4-dimethoxyphenyl)ethyl]-3-sulfamoylbenzamide
CID 45054358

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide?
The IUPAC name of 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide (CID 25046045) is 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide.
What is the SMILES notation for 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide?
The canonical SMILES for 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide is COc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)n1.
What is the InChIKey of 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide?
The InChIKey is DBCZISVYKRRQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O5S/c1-22-12-6-5-10(14(18-12)23-2)17-13(19)8-3-4-9(15)11(7-8)24(16,20)21/h3-7H,1-2H3,(H,17,19)(H2,16,20,21).
What are the key properties of 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide?
4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide has a molecular weight of 371.80 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,6-dimethoxy-3-pyridinyl)-3-sulfamoylbenzamide is sourced from PubChem (CID 25046045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).