2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide

C16H15Cl2FN2O4S — CID 18893075

IUPAC2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide
SMILESCOCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)c(F)c1
InChIInChI=1S/C16H15Cl2FN2O4S/c1-25-7-6-20-26(23,24)11-3-5-15(14(19)9-11)21-16(22)12-4-2-10(17)8-13(12)18/h2-5,8-9,20H,6-7H2,1H3,(H,21,22)
InChIKeyRDXZXOZNYNWLAT-UHFFFAOYSA-N
MW421.28 g/mol
LogP3.31
Rot. Bonds7

About 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide

2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide (PubChem CID 18893075) has the molecular formula C16H15Cl2FN2O4S and a molecular weight of 421.28 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide
PubChem CID18893075
Molecular FormulaC16H15Cl2FN2O4S
Molecular Weight421.28 g/mol
Exact Mass420.01
IUPAC Name2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide
SMILESCOCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)c(F)c1
InChIInChI=1S/C16H15Cl2FN2O4S/c1-25-7-6-20-26(23,24)11-3-5-15(14(19)9-11)21-16(22)12-4-2-10(17)8-13(12)18/h2-5,8-9,20H,6-7H2,1H3,(H,21,22)
InChIKeyRDXZXOZNYNWLAT-UHFFFAOYSA-N
XLogP3.31
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.28
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,4-dichloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
CID 18893079
2,4-dichloro-N-[2-fluoro-4-(3-morpholin-4-ylpropylsulfamoyl)phenyl]benzamide
CID 18893217
2,4-dichloro-N-[2-fluoro-4-[(2,4,5-trichlorophenyl)sulfamoyl]phenyl]benzamide
CID 18893127
2,4-dichloro-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893144
2,4-dichloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893102
2-chloro-N-[2-fluoro-4-(3-methylbutylsulfamoyl)phenyl]benzamide
CID 18893027
2,4-dichloro-N-[4-[(3-chlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18893111
2,4-dichloro-N-[2-fluoro-4-[(4-propan-2-ylphenyl)sulfamoyl]phenyl]benzamide
CID 18893105
N-[4-[(4-carbamoylphenyl)sulfamoyl]-2-fluorophenyl]-2,4-dichlorobenzamide
CID 18893156
4-chloro-N-[2-fluoro-4-(3-propan-2-yloxypropylsulfamoyl)phenyl]benzamide
CID 18892698
2-chloro-N-[2-fluoro-4-[(4-methoxyphenyl)methylsulfamoyl]phenyl]benzamide
CID 18892919
2,4-dichloro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4778992

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide (CID 18893075) is 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide is COCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)c(F)c1.
What is the InChIKey of 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide?
The InChIKey is RDXZXOZNYNWLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2FN2O4S/c1-25-7-6-20-26(23,24)11-3-5-15(14(19)9-11)21-16(22)12-4-2-10(17)8-13(12)18/h2-5,8-9,20H,6-7H2,1H3,(H,21,22).
What are the key properties of 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide?
2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide has a molecular weight of 421.28 g/mol, XLogP of 3.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-fluoro-4-(2-methoxyethylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 18893075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).