N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide

C19H12ClF3N2O3S — CID 3543799

IUPACN-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide
SMILESO=C(Nc1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl)c1ccc(F)cc1F
InChIInChI=1S/C19H12ClF3N2O3S/c20-14-8-6-12(29(27,28)25-17-4-2-1-3-15(17)22)10-18(14)24-19(26)13-7-5-11(21)9-16(13)23/h1-10,25H,(H,24,26)
InChIKeyOCBHVQLCGHRRFW-UHFFFAOYSA-N
MW440.83 g/mol
LogP4.81
Rot. Bonds5

About N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide

N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide (PubChem CID 3543799) has the molecular formula C19H12ClF3N2O3S and a molecular weight of 440.83 g/mol. Its IUPAC name is N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide
PubChem CID3543799
Molecular FormulaC19H12ClF3N2O3S
Molecular Weight440.83 g/mol
Exact Mass440.02
IUPAC NameN-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide
SMILESO=C(Nc1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl)c1ccc(F)cc1F
InChIInChI=1S/C19H12ClF3N2O3S/c20-14-8-6-12(29(27,28)25-17-4-2-1-3-15(17)22)10-18(14)24-19(26)13-7-5-11(21)9-16(13)23/h1-10,25H,(H,24,26)
InChIKeyOCBHVQLCGHRRFW-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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Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide?
The IUPAC name of N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide (CID 3543799) is N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide.
What is the SMILES notation for N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide?
The canonical SMILES for N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide is O=C(Nc1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl)c1ccc(F)cc1F.
What is the InChIKey of N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide?
The InChIKey is OCBHVQLCGHRRFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF3N2O3S/c20-14-8-6-12(29(27,28)25-17-4-2-1-3-15(17)22)10-18(14)24-19(26)13-7-5-11(21)9-16(13)23/h1-10,25H,(H,24,26).
What are the key properties of N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide?
N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide 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 N-[2-chloro-5-[(2-fluorophenyl)sulfamoyl]phenyl]-2,4-difluorobenzamide is sourced from PubChem (CID 3543799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).