4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide

C19H12ClF3N2O3S — CID 18892640

IUPAC4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C19H12ClF3N2O3S/c20-12-6-4-11(5-7-12)19(26)24-17-9-8-13(10-16(17)23)29(27,28)25-18-14(21)2-1-3-15(18)22/h1-10,25H,(H,24,26)
InChIKeyMLKXQTBZTWEHIC-UHFFFAOYSA-N
MW440.83 g/mol
LogP4.81
Rot. Bonds5

About 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide

4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide (PubChem CID 18892640) has the molecular formula C19H12ClF3N2O3S and a molecular weight of 440.83 g/mol. Its IUPAC name is 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
PubChem CID18892640
Molecular FormulaC19H12ClF3N2O3S
Molecular Weight440.83 g/mol
Exact Mass440.02
IUPAC Name4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C19H12ClF3N2O3S/c20-12-6-4-11(5-7-12)19(26)24-17-9-8-13(10-16(17)23)29(27,28)25-18-14(21)2-1-3-15(18)22/h1-10,25H,(H,24,26)
InChIKeyMLKXQTBZTWEHIC-UHFFFAOYSA-N
XLogP4.81
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.83
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[4-[(2,6-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892610
4-chloro-N-[2-fluoro-4-[(3-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 18892649
4-chloro-N-[4-[(2,5-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892609
3-chloro-N-[2-fluoro-4-[(2-fluorophenyl)sulfamoyl]phenyl]benzamide
CID 18892781
4-chloro-N-[4-(cyclopentylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892580
4-chloro-N-[4-(cyclooctylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892724
4-chloro-N-[4-(cyclohexylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892581
N-(4-chloro-2-fluorophenyl)-4-[(3-chloro-4-fluorophenyl)sulfonylamino]benzamide
CID 26696432
3-chloro-N-[4-[(2,3-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892770
4-chloro-N-[4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]-2-fluorophenyl]benzamide
CID 18892646
4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
CID 18892590
3-chloro-N-[2-fluoro-4-[(4-propan-2-ylphenyl)sulfamoyl]phenyl]benzamide
CID 18892779

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The IUPAC name of 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide (CID 18892640) is 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide.
What is the SMILES notation for 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The canonical SMILES for 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1F)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The InChIKey is MLKXQTBZTWEHIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF3N2O3S/c20-12-6-4-11(5-7-12)19(26)24-17-9-8-13(10-16(17)23)29(27,28)25-18-14(21)2-1-3-15(18)22/h1-10,25H,(H,24,26).
What are the key properties of 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide has a molecular weight of 440.83 g/mol, XLogP of 4.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide is sourced from PubChem (CID 18892640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).