4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide

C13H14ClN3O4S — CID 155452036

IUPAC4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(N)=O)c(NCc2ccco2)cc1Cl
InChIInChI=1S/C13H14ClN3O4S/c1-16-22(19,20)12-5-9(13(15)18)11(6-10(12)14)17-7-8-3-2-4-21-8/h2-6,16-17H,7H2,1H3,(H2,15,18)
InChIKeyLCBOBHDHNFBNLQ-UHFFFAOYSA-N
MW343.79 g/mol
LogP1.55
Rot. Bonds6

About 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide

4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide (PubChem CID 155452036) has the molecular formula C13H14ClN3O4S and a molecular weight of 343.79 g/mol. Its IUPAC name is 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide
PubChem CID155452036
Molecular FormulaC13H14ClN3O4S
Molecular Weight343.79 g/mol
Exact Mass343.04
IUPAC Name4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(N)=O)c(NCc2ccco2)cc1Cl
InChIInChI=1S/C13H14ClN3O4S/c1-16-22(19,20)12-5-9(13(15)18)11(6-10(12)14)17-7-8-3-2-4-21-8/h2-6,16-17H,7H2,1H3,(H2,15,18)
InChIKeyLCBOBHDHNFBNLQ-UHFFFAOYSA-N
XLogP1.55
TPSA114.43 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.79
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Furosemide
CID 3440
4-Chloro-2-[(furan-2-ylmethyl)ammonio]-5-sulfamoylbenzoate
CID 118985385
2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]-N-(furan-2-ylmethyl)benzamide
CID 3271562
Sodium furosemide
CID 23673593
4-chloro-3-(furan-2-ylmethylsulfamoyl)-N-(2-methoxyphenyl)benzamide
CID 2087030
3-[(3-chlorophenyl)sulfamoyl]-N-(furan-2-ylmethyl)-4-methylbenzamide
CID 2396097
N-(furan-2-ylmethyl)-6-morpholin-4-ylsulfonyl-4-oxo-1H-quinoline-3-carboxamide
CID 3239267
N-(2-furylmethyl)-N-methyl-6-{[(2-methylphenyl)amino]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 3239329
6-[(diethylamino)sulfonyl]-N-(2-furylmethyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 16195513
4-chloro-N-[3-(furan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 4061089
2-chloro-N-(furan-2-ylmethyl)-5-[methyl(phenyl)sulfamoyl]benzamide
CID 2548271
4-Chloro-2-[(2-furanylmethyl)amino]-5-[(methylamino)sulfonyl]benzoic acid
CID 46853798

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide?
The IUPAC name of 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide (CID 155452036) is 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide?
The canonical SMILES for 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1cc(C(N)=O)c(NCc2ccco2)cc1Cl.
What is the InChIKey of 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide?
The InChIKey is LCBOBHDHNFBNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O4S/c1-16-22(19,20)12-5-9(13(15)18)11(6-10(12)14)17-7-8-3-2-4-21-8/h2-6,16-17H,7H2,1H3,(H2,15,18).
What are the key properties of 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide?
4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide has a molecular weight of 343.79 g/mol, XLogP of 1.55, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 155452036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).