N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide

C19H19ClN2O4S — CID 8873029

IUPACN-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)c2cc3ccccc3o2)ccc1Cl
InChIInChI=1S/C19H19ClN2O4S/c1-3-22(4-2)27(24,25)18-12-14(9-10-15(18)20)21-19(23)17-11-13-7-5-6-8-16(13)26-17/h5-12H,3-4H2,1-2H3,(H,21,23)
InChIKeyQQTVIFZHVGVPAT-UHFFFAOYSA-N
MW406.89 g/mol
LogP4.37
Rot. Bonds6

About N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide

N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide (PubChem CID 8873029) has the molecular formula C19H19ClN2O4S and a molecular weight of 406.89 g/mol. Its IUPAC name is N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
PubChem CID8873029
Molecular FormulaC19H19ClN2O4S
Molecular Weight406.89 g/mol
Exact Mass406.08
IUPAC NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)c2cc3ccccc3o2)ccc1Cl
InChIInChI=1S/C19H19ClN2O4S/c1-3-22(4-2)27(24,25)18-12-14(9-10-15(18)20)21-19(23)17-11-13-7-5-6-8-16(13)26-17/h5-12H,3-4H2,1-2H3,(H,21,23)
InChIKeyQQTVIFZHVGVPAT-UHFFFAOYSA-N
XLogP4.37
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.89
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(tert-butylsulfamoyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]furan-2-carboxamide
CID 55666487
N-[4-chloro-3-(diethylsulfamoyl)phenyl]-3-phenyl-1,2-oxazole-5-carboxamide
CID 55666411
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-1-benzofuran-2-carboxamide
CID 4054605
4-(aminomethyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]benzamide
CID 119266237
N-(3-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24708217
N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-oxochromene-2-carboxamide
CID 25443449
N-[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]-1-benzofuran-2-carboxamide
CID 47022693
2-(4-aminophenyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide
CID 119679886
2-(4-aminophenyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide;hydrochloride
CID 119679885
2-chloro-N-[(2R)-1-[4-chloro-3-(diethylsulfamoyl)anilino]-1-oxopropan-2-yl]benzamide
CID 41153673
6-chloro-N-[4-chloro-3-(diethylsulfamoyl)phenyl]quinoline-7-carboxamide
CID 155288495
4-chloro-3-(diethylsulfamoyl)-N-(2-methyl-1,3-benzoxazol-5-yl)benzamide
CID 26663982

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide (CID 8873029) is N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide is CCN(CC)S(=O)(=O)c1cc(NC(=O)c2cc3ccccc3o2)ccc1Cl.
What is the InChIKey of N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide?
The InChIKey is QQTVIFZHVGVPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O4S/c1-3-22(4-2)27(24,25)18-12-14(9-10-15(18)20)21-19(23)17-11-13-7-5-6-8-16(13)26-17/h5-12H,3-4H2,1-2H3,(H,21,23).
What are the key properties of N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide?
N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide has a molecular weight of 406.89 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(diethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 8873029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).