4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide

C21H18ClN3O4S — CID 26592920

IUPAC4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1
InChIInChI=1S/C21H18ClN3O4S/c1-14(26)23-17-9-5-15(6-10-17)21(27)24-19-3-2-4-20(13-19)30(28,29)25-18-11-7-16(22)8-12-18/h2-13,25H,1H3,(H,23,26)(H,24,27)
InChIKeyQQBJNIDVWTXHIH-UHFFFAOYSA-N
MW443.91 g/mol
LogP4.35
Rot. Bonds6

About 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide

4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide (PubChem CID 26592920) has the molecular formula C21H18ClN3O4S and a molecular weight of 443.91 g/mol. Its IUPAC name is 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide
PubChem CID26592920
Molecular FormulaC21H18ClN3O4S
Molecular Weight443.91 g/mol
Exact Mass443.07
IUPAC Name4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1
InChIInChI=1S/C21H18ClN3O4S/c1-14(26)23-17-9-5-15(6-10-17)21(27)24-19-3-2-4-20(13-19)30(28,29)25-18-11-7-16(22)8-12-18/h2-13,25H,1H3,(H,23,26)(H,24,27)
InChIKeyQQBJNIDVWTXHIH-UHFFFAOYSA-N
XLogP4.35
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.91
LogP ≤ 54.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 26663686
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 51162183
4-acetamido-N-(3-sulfamoylphenyl)benzamide
CID 4067351
N-(4-bromophenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 1087366
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide
CID 55819813
4-[(4-chlorophenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 7553542
N-(4-chlorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 7720348
4-[(4-chlorophenyl)sulfamoyl]-N-(4-methylphenyl)benzamide
CID 9411666
N-(5-acetamido-2-chlorophenyl)-4-(benzenesulfonamido)benzamide
CID 55981241
2,5-dichloro-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]thiophene-3-carboxamide
CID 26720210
N-[4-[(3-chlorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 3918199
N-[3-[(4-chlorophenyl)sulfonylamino]phenyl]benzamide
CID 1216913

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide (CID 26592920) is 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide is CC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1.
What is the InChIKey of 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide?
The InChIKey is QQBJNIDVWTXHIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O4S/c1-14(26)23-17-9-5-15(6-10-17)21(27)24-19-3-2-4-20(13-19)30(28,29)25-18-11-7-16(22)8-12-18/h2-13,25H,1H3,(H,23,26)(H,24,27).
What are the key properties of 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide?
4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide has a molecular weight of 443.91 g/mol, XLogP of 4.35, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 26592920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).