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

C18H13Cl2N3O3S — CID 1078174

IUPAC3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H13Cl2N3O3S/c19-15-9-4-12(11-16(15)20)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24)
InChIKeyIEHKHUWGDTVMNI-UHFFFAOYSA-N
MW422.29 g/mol
LogP4.44
Rot. Bonds5

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

3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 1078174) has the molecular formula C18H13Cl2N3O3S and a molecular weight of 422.29 g/mol. Its IUPAC name is 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
PubChem CID1078174
Molecular FormulaC18H13Cl2N3O3S
Molecular Weight422.29 g/mol
Exact Mass421.01
IUPAC Name3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H13Cl2N3O3S/c19-15-9-4-12(11-16(15)20)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24)
InChIKeyIEHKHUWGDTVMNI-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

Analyze 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]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

3,4-dimethyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078179
3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 92677705
4-(methanesulfonamido)-3-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 30396142
4-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide;2,2,2-trifluoroacetic acid
CID 53257044
4-[[4-(pyridin-2-ylsulfamoyl)phenyl]sulfamoyl]benzoic acid
CID 4918646
2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 53257051
2-chloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 71300028
2-methyl-3-oxo-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-4H-1,4-benzothiazine-6-carboxamide
CID 162520983
3-(2-chlorophenyl)-5-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
CID 19176544
N-[4-(pyridin-2-ylsulfamoyl)phenyl]naphthalene-1-carboxamide
CID 19204277
N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725106
4-(piperidin-1-ylsulfonylmethyl)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 43909304

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (CID 1078174) is 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is IEHKHUWGDTVMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O3S/c19-15-9-4-12(11-16(15)20)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24).
What are the key properties of 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]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 3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 1078174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).