N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide

C13H9ClF2N2O3S — CID 121267983

IUPACN-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F
InChIInChI=1S/C13H9ClF2N2O3S/c14-9-6-7(4-5-10(9)15)18-13(19)8-2-1-3-11(12(8)16)22(17,20)21/h1-6H,(H,18,19)(H2,17,20,21)
InChIKeyWQBDRJZZIFHNNX-UHFFFAOYSA-N
MW346.74 g/mol
LogP2.52
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide

N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide (PubChem CID 121267983) has the molecular formula C13H9ClF2N2O3S and a molecular weight of 346.74 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide
PubChem CID121267983
Molecular FormulaC13H9ClF2N2O3S
Molecular Weight346.74 g/mol
Exact Mass346.00
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F
InChIInChI=1S/C13H9ClF2N2O3S/c14-9-6-7(4-5-10(9)15)18-13(19)8-2-1-3-11(12(8)16)22(17,20)21/h1-6H,(H,18,19)(H2,17,20,21)
InChIKeyWQBDRJZZIFHNNX-UHFFFAOYSA-N
XLogP2.52
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.74
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide 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

N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide
CID 80719146
2-chloro-N-(3-chloro-4-fluorophenyl)-5-sulfamoylbenzamide
CID 36704856
3-amino-2-chloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 112574586
N-(3-chloro-4-fluorophenyl)-2-(4-sulfamoylphenyl)sulfanylbenzamide
CID 75534018
2,3-difluoro-N-(4-sulfamoylphenyl)benzamide
CID 62649490
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
N-(3-chloro-4-fluorophenyl)-2-iodobenzamide
CID 615783
N-(3-chloro-4-fluorophenyl)-9-oxofluorene-1-carboxamide
CID 25234468
N-(3-chloro-4-sulfamoylphenyl)-3-fluoropyridine-4-carboxamide
CID 64951270
N-(4-bromo-3-fluorophenyl)-3-chloro-2-fluorobenzamide
CID 81002084
N-(3,4-difluorophenyl)-2,3-difluorobenzamide
CID 62648495
N-(4-amino-3-chlorophenyl)-2-fluoro-3-methylbenzamide
CID 82861951

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide (CID 121267983) is N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide is NS(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide?
The InChIKey is WQBDRJZZIFHNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2N2O3S/c14-9-6-7(4-5-10(9)15)18-13(19)8-2-1-3-11(12(8)16)22(17,20)21/h1-6H,(H,18,19)(H2,17,20,21).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide?
N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide has a molecular weight of 346.74 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide is sourced from PubChem (CID 121267983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).