4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide

C13H8Cl3FN2O3S — CID 100913416

IUPAC4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2Cl)c(F)cc1Cl
InChIInChI=1S/C13H8Cl3FN2O3S/c14-6-1-2-11(8(15)3-6)19-13(20)7-4-12(23(18,21)22)9(16)5-10(7)17/h1-5H,(H,19,20)(H2,18,21,22)
InChIKeyGDEKWOOCARQFRL-UHFFFAOYSA-N
MW397.64 g/mol
LogP3.69
Rot. Bonds3

About 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide

4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide (PubChem CID 100913416) has the molecular formula C13H8Cl3FN2O3S and a molecular weight of 397.64 g/mol. Its IUPAC name is 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide
PubChem CID100913416
Molecular FormulaC13H8Cl3FN2O3S
Molecular Weight397.64 g/mol
Exact Mass395.93
IUPAC Name4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2Cl)c(F)cc1Cl
InChIInChI=1S/C13H8Cl3FN2O3S/c14-6-1-2-11(8(15)3-6)19-13(20)7-4-12(23(18,21)22)9(16)5-10(7)17/h1-5H,(H,19,20)(H2,18,21,22)
InChIKeyGDEKWOOCARQFRL-UHFFFAOYSA-N
XLogP3.69
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.64
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2-ethylphenyl)-2-fluoro-5-sulfamoylbenzamide
CID 100913420
2-bromo-N-(2,4-dichlorophenyl)-4-fluorobenzamide
CID 27666994
4-chloro-N-(2,2-dimethylbutyl)-2-fluoro-5-sulfamoylbenzamide
CID 103465691
4-chloro-2-fluoro-N-(4-methylpentan-2-yl)-5-sulfamoylbenzamide
CID 65387595
2,4-diamino-N-(2,4-dichlorophenyl)benzamide
CID 61091411
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
4-chloro-2-fluoro-N-(2-methoxy-2-methylpropyl)-5-sulfamoylbenzamide
CID 104766743
N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
CID 5150334
3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide
CID 13456235
5-amino-N-(4-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 61112671
2,4-dichloro-N-[2-fluoro-4-[(2,4,5-trichlorophenyl)sulfamoyl]phenyl]benzamide
CID 18893127
N-(2-bromo-4-chlorophenyl)-4-chloro-2-fluorobenzamide
CID 81027870

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide?
The IUPAC name of 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide (CID 100913416) is 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide.
What is the SMILES notation for 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide?
The canonical SMILES for 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide is NS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2Cl)c(F)cc1Cl.
What is the InChIKey of 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide?
The InChIKey is GDEKWOOCARQFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl3FN2O3S/c14-6-1-2-11(8(15)3-6)19-13(20)7-4-12(23(18,21)22)9(16)5-10(7)17/h1-5H,(H,19,20)(H2,18,21,22).
What are the key properties of 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide?
4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide has a molecular weight of 397.64 g/mol, XLogP of 3.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,4-dichlorophenyl)-2-fluoro-5-sulfamoylbenzamide is sourced from PubChem (CID 100913416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).