3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide

C19H12Cl3FN2O3S — CID 18892799

IUPAC3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)c(Cl)c2)cc1F)c1cccc(Cl)c1
InChIInChI=1S/C19H12Cl3FN2O3S/c20-12-3-1-2-11(8-12)19(26)24-18-7-5-14(10-17(18)23)29(27,28)25-13-4-6-15(21)16(22)9-13/h1-10,25H,(H,24,26)
InChIKeyRESKWUWKIHKVIU-UHFFFAOYSA-N
MW473.74 g/mol
LogP5.84
Rot. Bonds5

About 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide

3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide (PubChem CID 18892799) has the molecular formula C19H12Cl3FN2O3S and a molecular weight of 473.74 g/mol. Its IUPAC name is 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
PubChem CID18892799
Molecular FormulaC19H12Cl3FN2O3S
Molecular Weight473.74 g/mol
Exact Mass471.96
IUPAC Name3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)c(Cl)c2)cc1F)c1cccc(Cl)c1
InChIInChI=1S/C19H12Cl3FN2O3S/c20-12-3-1-2-11(8-12)19(26)24-18-7-5-14(10-17(18)23)29(27,28)25-13-4-6-15(21)16(22)9-13/h1-10,25H,(H,24,26)
InChIKeyRESKWUWKIHKVIU-UHFFFAOYSA-N
XLogP5.84
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.74
LogP ≤ 55.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[2-fluoro-4-[(4-propan-2-ylphenyl)sulfamoyl]phenyl]benzamide
CID 18892779
3-chloro-N-[2-fluoro-4-[(2-fluorophenyl)sulfamoyl]phenyl]benzamide
CID 18892781
3-chloro-N-[4-[[4-chloro-2-(trifluoromethyl)phenyl]sulfamoyl]-2-fluorophenyl]benzamide
CID 18892877
2,4-dichloro-N-[4-[(3-chlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893111
3-chloro-N-[4-[(2,3-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892770
N-(4-chloro-2-fluorophenyl)-4-[(3-chloro-4-fluorophenyl)sulfonylamino]benzamide
CID 26696432
4-chloro-N-[4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]-2-fluorophenyl]benzamide
CID 18892646
N-(5-acetamido-2-chlorophenyl)-3-[(3-fluoro-4-methylphenyl)sulfonylamino]benzamide
CID 55980726
N-[4-(butan-2-ylsulfamoyl)-2-fluorophenyl]-3-chlorobenzamide
CID 18892739
4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892640
4-chloro-N-[2-fluoro-4-[(3-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 18892649
N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide
CID 25471428

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The IUPAC name of 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide (CID 18892799) is 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The canonical SMILES for 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)c(Cl)c2)cc1F)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
The InChIKey is RESKWUWKIHKVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl3FN2O3S/c20-12-3-1-2-11(8-12)19(26)24-18-7-5-14(10-17(18)23)29(27,28)25-13-4-6-15(21)16(22)9-13/h1-10,25H,(H,24,26).
What are the key properties of 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide?
3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide has a molecular weight of 473.74 g/mol, XLogP of 5.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide is sourced from PubChem (CID 18892799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).