4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide

C20H15Cl2FN2O3S — CID 18892590

IUPAC4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C20H15Cl2FN2O3S/c21-15-7-5-13(6-8-15)20(26)25-19-10-9-16(11-18(19)23)29(27,28)24-12-14-3-1-2-4-17(14)22/h1-11,24H,12H2,(H,25,26)
InChIKeySKUXNGAEWPHKBL-UHFFFAOYSA-N
MW453.32 g/mol
LogP4.86
Rot. Bonds6

About 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide

4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide (PubChem CID 18892590) has the molecular formula C20H15Cl2FN2O3S and a molecular weight of 453.32 g/mol. Its IUPAC name is 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
PubChem CID18892590
Molecular FormulaC20H15Cl2FN2O3S
Molecular Weight453.32 g/mol
Exact Mass452.02
IUPAC Name4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C20H15Cl2FN2O3S/c21-15-7-5-13(6-8-15)20(26)25-19-10-9-16(11-18(19)23)29(27,28)24-12-14-3-1-2-4-17(14)22/h1-11,24H,12H2,(H,25,26)
InChIKeySKUXNGAEWPHKBL-UHFFFAOYSA-N
XLogP4.86
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.32
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
CID 18893079
4-chloro-N-[2-fluoro-4-(pyridin-4-ylmethylsulfamoyl)phenyl]benzamide
CID 18892602
N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide
CID 3689795
4-fluoro-N-[2-fluoro-4-[(2-methoxyphenyl)methylsulfamoyl]phenyl]benzamide
CID 18893514
3-chloro-N-[(2-chlorophenyl)methyl]-4-fluorobenzenesulfonamide
CID 3348028
4-chloro-N-[(2-chlorophenyl)methyl]benzenesulfonamide
CID 2492101
4-chloro-N-[4-[(2,6-difluorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892640
5-[(2-chlorophenyl)methylsulfamoyl]-N-(2,3-dimethylphenyl)-2-fluorobenzamide
CID 5142552
N-[2-chloro-4-[(2-chlorophenyl)methylsulfamoyl]phenyl]acetamide
CID 25037659
3-amino-N-[(2-chlorophenyl)methyl]-4-fluorobenzenesulfonamide
CID 29269508
N-(4-chloro-2-fluorophenyl)-4-(ethylsulfamoyl)benzamide
CID 9211461
4-chloro-N-[2-fluoro-4-(3-propan-2-yloxypropylsulfamoyl)phenyl]benzamide
CID 18892698

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide?
The IUPAC name of 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide (CID 18892590) is 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide.
What is the SMILES notation for 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide?
The canonical SMILES for 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1F)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide?
The InChIKey is SKUXNGAEWPHKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2FN2O3S/c21-15-7-5-13(6-8-15)20(26)25-19-10-9-16(11-18(19)23)29(27,28)24-12-14-3-1-2-4-17(14)22/h1-11,24H,12H2,(H,25,26).
What are the key properties of 4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide?
4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide has a molecular weight of 453.32 g/mol, XLogP of 4.86, 6 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-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide is sourced from PubChem (CID 18892590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).