N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide

C19H12Cl2F2N2O3S — CID 18893289

IUPACN-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1F)c1ccccc1F
InChIInChI=1S/C19H12Cl2F2N2O3S/c20-11-7-12(21)9-13(8-11)25-29(27,28)14-5-6-18(17(23)10-14)24-19(26)15-3-1-2-4-16(15)22/h1-10,25H,(H,24,26)
InChIKeyUWTODAHFBDRCDJ-UHFFFAOYSA-N
MW457.29 g/mol
LogP5.32
Rot. Bonds5

About N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide

N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide (PubChem CID 18893289) has the molecular formula C19H12Cl2F2N2O3S and a molecular weight of 457.29 g/mol. Its IUPAC name is N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide
PubChem CID18893289
Molecular FormulaC19H12Cl2F2N2O3S
Molecular Weight457.29 g/mol
Exact Mass455.99
IUPAC NameN-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1F)c1ccccc1F
InChIInChI=1S/C19H12Cl2F2N2O3S/c20-11-7-12(21)9-13(8-11)25-29(27,28)14-5-6-18(17(23)10-14)24-19(26)15-3-1-2-4-16(15)22/h1-10,25H,(H,24,26)
InChIKeyUWTODAHFBDRCDJ-UHFFFAOYSA-N
XLogP5.32
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.29
LogP ≤ 55.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[2-fluoro-4-(phenylsulfamoyl)phenyl]benzamide
CID 18893255
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-fluorobenzamide
CID 17069483
2-fluoro-N-[2-fluoro-4-[(4-iodophenyl)sulfamoyl]phenyl]benzamide
CID 18893279
2-fluoro-N-[2-fluoro-4-[(3-methylsulfanylphenyl)sulfamoyl]phenyl]benzamide
CID 18893315
2,4-dichloro-N-[4-[(3-chlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893111
N-[4-[(3,4-dimethoxyphenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide
CID 18893309
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2-fluorobenzamide
CID 55349327
N-[4-[(2,6-diethylphenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide
CID 18893361
N-[4-[(4-carbamoylphenyl)sulfamoyl]-2-fluorophenyl]-2-chlorobenzamide
CID 18892993
2,4-dichloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893102
2-fluoro-N-[2-fluoro-4-(3-hydroxypropylsulfamoyl)phenyl]benzamide
CID 18893237
N-(3,5-dichlorophenyl)-3,4-difluorobenzenesulfonamide
CID 3702957

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide?
The IUPAC name of N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide (CID 18893289) is N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide.
What is the SMILES notation for N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide?
The canonical SMILES for N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide is O=C(Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1F)c1ccccc1F.
What is the InChIKey of N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide?
The InChIKey is UWTODAHFBDRCDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2F2N2O3S/c20-11-7-12(21)9-13(8-11)25-29(27,28)14-5-6-18(17(23)10-14)24-19(26)15-3-1-2-4-16(15)22/h1-10,25H,(H,24,26).
What are the key properties of N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide?
N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide has a molecular weight of 457.29 g/mol, XLogP of 5.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,5-dichlorophenyl)sulfamoyl]-2-fluorophenyl]-2-fluorobenzamide is sourced from PubChem (CID 18893289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).