N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide

C21H18Cl2N2O4S — CID 90342780

IUPACN-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1
InChIInChI=1S/C21H18Cl2N2O4S/c1-25(18-10-6-16(23)7-11-18)30(27,28)20-13-14(3-12-19(20)29-2)21(26)24-17-8-4-15(22)5-9-17/h3-13H,1-2H3,(H,24,26)
InChIKeyQLKKQCGZSOHXRF-UHFFFAOYSA-N
MW465.36 g/mol
LogP5.08
Rot. Bonds6

About N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide

N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide (PubChem CID 90342780) has the molecular formula C21H18Cl2N2O4S and a molecular weight of 465.36 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide
PubChem CID90342780
Molecular FormulaC21H18Cl2N2O4S
Molecular Weight465.36 g/mol
Exact Mass464.04
IUPAC NameN-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1
InChIInChI=1S/C21H18Cl2N2O4S/c1-25(18-10-6-16(23)7-11-18)30(27,28)20-13-14(3-12-19(20)29-2)21(26)24-17-8-4-15(22)5-9-17/h3-13H,1-2H3,(H,24,26)
InChIKeyQLKKQCGZSOHXRF-UHFFFAOYSA-N
XLogP5.08
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.36
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dichlorophenyl)-4-({[(3-methoxyphenyl)sulfonyl]amino}methyl)benzamide
CID 984403
N-(3-chlorophenyl)-4-({[(3-methoxyphenyl)sulfonyl]amino}methyl)benzamide
CID 984406
4-methoxy-N-(3-methylphenyl)-3-(morpholin-4-ylsulfonyl)benzamide
CID 1216502
methyl 2-({N-(4-chlorophenyl)-N-[(4-methoxyphenyl)sulfonyl]glycyl}amino)benzoate
CID 1319935
Cambridge id 7106602
CID 1332587
4-methoxy-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide
CID 1349637
2-chloro-N-(3-cyanophenyl)-5-[(4-methoxyphenyl)-prop-2-enylsulfamoyl]benzamide
CID 2084185
2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 2089490
N-cycloheptyl-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzamide
CID 2109848
3-[(2-chlorophenyl)-prop-2-enylsulfamoyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 2447527
4-chloro-N-(2-methoxyphenyl)-3-(piperidin-1-ylsulfonyl)benzamide
CID 2704849
N-[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]phenyl]-4-methoxybenzamide
CID 3469023

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide?
The IUPAC name of N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide (CID 90342780) is N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide?
The canonical SMILES for N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide?
The InChIKey is QLKKQCGZSOHXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18Cl2N2O4S/c1-25(18-10-6-16(23)7-11-18)30(27,28)20-13-14(3-12-19(20)29-2)21(26)24-17-8-4-15(22)5-9-17/h3-13H,1-2H3,(H,24,26).
What are the key properties of N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide?
N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide has a molecular weight of 465.36 g/mol, XLogP of 5.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]-4-methoxybenzamide is sourced from PubChem (CID 90342780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).