N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide

C20H15Cl2FN2O3S — CID 3689795

IUPACN-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(F)c(S(=O)(=O)NCc2ccccc2Cl)c1
InChIInChI=1S/C20H15Cl2FN2O3S/c21-15-6-2-1-5-14(15)12-24-29(27,28)19-11-13(9-10-17(19)23)20(26)25-18-8-4-3-7-16(18)22/h1-11,24H,12H2,(H,25,26)
InChIKeyLKMAXQRCSWDGDS-UHFFFAOYSA-N
MW453.32 g/mol
LogP4.86
Rot. Bonds6

About N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide

N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide (PubChem CID 3689795) has the molecular formula C20H15Cl2FN2O3S and a molecular weight of 453.32 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide
PubChem CID3689795
Molecular FormulaC20H15Cl2FN2O3S
Molecular Weight453.32 g/mol
Exact Mass452.02
IUPAC NameN-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(F)c(S(=O)(=O)NCc2ccccc2Cl)c1
InChIInChI=1S/C20H15Cl2FN2O3S/c21-15-6-2-1-5-14(15)12-24-29(27,28)19-11-13(9-10-17(19)23)20(26)25-18-8-4-3-7-16(18)22/h1-11,24H,12H2,(H,25,26)
InChIKeyLKMAXQRCSWDGDS-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

3-[(2-chlorophenyl)methylsulfamoyl]-4-fluoro-N-(4-propan-2-ylphenyl)benzamide
CID 3526066
4-chloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
CID 18892590
N-(2-chlorophenyl)-4-fluoro-3-piperidin-1-ylsulfonylbenzamide
CID 26575157
N-(2-chlorophenyl)-3-(cycloheptylsulfamoyl)-4-fluorobenzamide
CID 5008740
2,4-dichloro-N-[(2-chlorophenyl)methyl]benzenesulfonamide
CID 125467959
5-amino-N-[(2-chlorophenyl)methyl]-2,4-difluorobenzenesulfonamide
CID 28537421
2,4-dichloro-N-[4-[(2-chlorophenyl)methylsulfamoyl]-2-fluorophenyl]benzamide
CID 18893079
3-[(4-chlorophenyl)methylsulfamoyl]-N-(2-ethylphenyl)-4-methoxybenzamide
CID 55525275
5-[(2-chlorophenyl)methylsulfamoyl]-N-(2,3-dimethylphenyl)-2-fluorobenzamide
CID 5142552
N-(2-chlorophenyl)-2-[(2-chlorophenyl)methylamino]pyrimidine-5-carboxamide
CID 109257535
4-fluoro-3-(prop-2-enylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide
CID 126479526
3-chloro-N-[(2-chlorophenyl)methyl]-4-fluorobenzenesulfonamide
CID 3348028

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide?
The IUPAC name of N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide (CID 3689795) is N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide?
The canonical SMILES for N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide is O=C(Nc1ccccc1Cl)c1ccc(F)c(S(=O)(=O)NCc2ccccc2Cl)c1.
What is the InChIKey of N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide?
The InChIKey is LKMAXQRCSWDGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2FN2O3S/c21-15-6-2-1-5-14(15)12-24-29(27,28)19-11-13(9-10-17(19)23)20(26)25-18-8-4-3-7-16(18)22/h1-11,24H,12H2,(H,25,26).
What are the key properties of N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide?
N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide 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 N-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfamoyl]-4-fluorobenzamide is sourced from PubChem (CID 3689795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).