2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide

C18H13Cl2N3O3S — CID 2996026

IUPAC2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide
SMILESO=C(Nc1ccccc1)c1cc(S(=O)(=O)Nc2cccnc2)c(Cl)cc1Cl
InChIInChI=1S/C18H13Cl2N3O3S/c19-15-10-16(20)17(27(25,26)23-13-7-4-8-21-11-13)9-14(15)18(24)22-12-5-2-1-3-6-12/h1-11,23H,(H,22,24)
InChIKeyIRRACJFGJZBZLP-UHFFFAOYSA-N
MW422.29 g/mol
LogP4.44
Rot. Bonds5

About 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide

2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide (PubChem CID 2996026) has the molecular formula C18H13Cl2N3O3S and a molecular weight of 422.29 g/mol. Its IUPAC name is 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide
PubChem CID2996026
Molecular FormulaC18H13Cl2N3O3S
Molecular Weight422.29 g/mol
Exact Mass421.01
IUPAC Name2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide
SMILESO=C(Nc1ccccc1)c1cc(S(=O)(=O)Nc2cccnc2)c(Cl)cc1Cl
InChIInChI=1S/C18H13Cl2N3O3S/c19-15-10-16(20)17(27(25,26)23-13-7-4-8-21-11-13)9-14(15)18(24)22-12-5-2-1-3-6-12/h1-11,23H,(H,22,24)
InChIKeyIRRACJFGJZBZLP-UHFFFAOYSA-N
XLogP4.44
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.29
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 43904807
acetic acid;2,4-dichloro-5-[(4-chlorophenyl)sulfamoyl]-N-phenylbenzamide
CID 90484937
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide
CID 19257517
2,4-dichloro-5-(dimethylsulfamoyl)-N-pyridin-3-ylbenzamide
CID 1260020
2,4-dichloro-5-(pyridin-4-ylsulfamoyl)benzoic acid
CID 29050395
2,4-dichloro-5-(cyclohexylsulfamoyl)-N-phenylbenzamide
CID 1356387
2-chloro-5-hydroxy-N-pyridin-3-ylbenzamide
CID 106501191
2-chloro-N-(2-nitrophenyl)-5-(pyridin-3-ylsulfamoyl)benzamide
CID 25040314
2,4-dichloro-5-[(2-hydroxyphenyl)-methylsulfamoyl]-N-phenylbenzamide
CID 26435626
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
2-methyl-3-(pyridin-3-ylsulfamoyl)benzoic acid
CID 63742304
2,6-dichloro-N-pyridin-3-ylbenzenesulfonamide
CID 890470

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide?
The IUPAC name of 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide (CID 2996026) is 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide.
What is the SMILES notation for 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide?
The canonical SMILES for 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide is O=C(Nc1ccccc1)c1cc(S(=O)(=O)Nc2cccnc2)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide?
The InChIKey is IRRACJFGJZBZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O3S/c19-15-10-16(20)17(27(25,26)23-13-7-4-8-21-11-13)9-14(15)18(24)22-12-5-2-1-3-6-12/h1-11,23H,(H,22,24).
What are the key properties of 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide?
2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide has a molecular weight of 422.29 g/mol, XLogP of 4.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide is sourced from PubChem (CID 2996026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).