3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide

C20H17ClN2O4S — CID 4646574

IUPAC3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)cc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C20H17ClN2O4S/c1-27-19-11-10-17(28(25,26)23-16-8-3-2-4-9-16)13-18(19)22-20(24)14-6-5-7-15(21)12-14/h2-13,23H,1H3,(H,22,24)
InChIKeyGZQLUJILOYXBCH-UHFFFAOYSA-N
MW416.89 g/mol
LogP4.40
Rot. Bonds6

About 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide

3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide (PubChem CID 4646574) has the molecular formula C20H17ClN2O4S and a molecular weight of 416.89 g/mol. Its IUPAC name is 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide
PubChem CID4646574
Molecular FormulaC20H17ClN2O4S
Molecular Weight416.89 g/mol
Exact Mass416.06
IUPAC Name3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)cc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C20H17ClN2O4S/c1-27-19-11-10-17(28(25,26)23-16-8-3-2-4-9-16)13-18(19)22-20(24)14-6-5-7-15(21)12-14/h2-13,23H,1H3,(H,22,24)
InChIKeyGZQLUJILOYXBCH-UHFFFAOYSA-N
XLogP4.40
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.89
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(4-butylphenyl)sulfamoyl]-2-methoxyphenyl]-3-chlorobenzamide
CID 3995108
3-(benzenesulfonamido)-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 43910095
N-[5-(butylsulfamoyl)-2-methoxyphenyl]-3-chlorobenzamide
CID 4983601
4-methoxy-3-[[4-(phenylsulfamoyl)benzoyl]amino]benzamide
CID 55963635
3-(benzenesulfonamido)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 46771385
N-[5-[(3-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]benzamide
CID 36925968
3-(benzenesulfonamido)-N-(2-methoxy-5-nitrophenyl)benzamide
CID 19062366
N-[5-[(3-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-4-methoxy-3-nitrobenzamide
CID 24673057
3-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(2-fluorophenyl)benzamide
CID 26584389
3-benzamido-4-methoxybenzenesulfonyl chloride
CID 43140030
3-[(3,4-dichlorophenyl)sulfonylamino]-4-methoxy-N-phenylbenzamide
CID 18626240
N-(3-acetamido-4-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 24666755

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide?
The IUPAC name of 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide (CID 4646574) is 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide is COc1ccc(S(=O)(=O)Nc2ccccc2)cc1NC(=O)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide?
The InChIKey is GZQLUJILOYXBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4S/c1-27-19-11-10-17(28(25,26)23-16-8-3-2-4-9-16)13-18(19)22-20(24)14-6-5-7-15(21)12-14/h2-13,23H,1H3,(H,22,24).
What are the key properties of 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide?
3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide has a molecular weight of 416.89 g/mol, XLogP of 4.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[2-methoxy-5-(phenylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 4646574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).