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

C20H16Cl2N2O4S — CID 1279671

IUPACN-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H16Cl2N2O4S/c1-28-18-11-2-13(20(25)23-16-7-3-14(21)4-8-16)12-19(18)29(26,27)24-17-9-5-15(22)6-10-17/h2-12,24H,1H3,(H,23,25)
InChIKeyNZJYJGPARUWSKU-UHFFFAOYSA-N
MW451.33 g/mol
LogP5.06
Rot. Bonds6

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

N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide (PubChem CID 1279671) has the molecular formula C20H16Cl2N2O4S and a molecular weight of 451.33 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide
PubChem CID1279671
Molecular FormulaC20H16Cl2N2O4S
Molecular Weight451.33 g/mol
Exact Mass450.02
IUPAC NameN-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H16Cl2N2O4S/c1-28-18-11-2-13(20(25)23-16-7-3-14(21)4-8-16)12-19(18)29(26,27)24-17-9-5-15(22)6-10-17/h2-12,24H,1H3,(H,23,25)
InChIKeyNZJYJGPARUWSKU-UHFFFAOYSA-N
XLogP5.06
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.33
LogP ≤ 55.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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
2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 2089490
3-[(2-chlorophenyl)-prop-2-enylsulfamoyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 2447527
2-(2-chloro-6-fluorophenyl)-N-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 3403874
N-[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]phenyl]-4-methoxybenzamide
CID 3469023
N-(3,5-Dichlorophenyl)-4-fluoro-3-{[(4-methoxyphenyl)methyl]sulfamoyl}benzamide
CID 4069796
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 4359591
2-fluoro-5-{[(4-methoxybenzyl)amino]sulfonyl}-N-(4-methoxyphenyl)benzamide
CID 4399856
N-[4-chloro-3-[(4-chlorophenyl)sulfamoyl]phenyl]-4-propan-2-yloxybenzamide
CID 4422794
N-[4-chloro-3-[(4-ethoxyphenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 4830569

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide?
The IUPAC name of N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide (CID 1279671) is N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide?
The canonical SMILES for N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide?
The InChIKey is NZJYJGPARUWSKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N2O4S/c1-28-18-11-2-13(20(25)23-16-7-3-14(21)4-8-16)12-19(18)29(26,27)24-17-9-5-15(22)6-10-17/h2-12,24H,1H3,(H,23,25).
What are the key properties of N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide?
N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide has a molecular weight of 451.33 g/mol, XLogP of 5.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfamoyl]-4-methoxybenzamide is sourced from PubChem (CID 1279671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).