N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide

C20H16Cl2N2O4S — CID 4529855

IUPACN-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C20H16Cl2N2O4S/c1-28-19-5-3-2-4-18(19)20(25)23-15-6-8-17(9-7-15)29(26,27)24-16-11-13(21)10-14(22)12-16/h2-12,24H,1H3,(H,23,25)
InChIKeyRXCYZQRLCYHMFP-UHFFFAOYSA-N
MW451.33 g/mol
LogP5.06
Rot. Bonds6

About N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide

N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide (PubChem CID 4529855) has the molecular formula C20H16Cl2N2O4S and a molecular weight of 451.33 g/mol. Its IUPAC name is N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide
PubChem CID4529855
Molecular FormulaC20H16Cl2N2O4S
Molecular Weight451.33 g/mol
Exact Mass450.02
IUPAC NameN-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C20H16Cl2N2O4S/c1-28-19-5-3-2-4-18(19)20(25)23-15-6-8-17(9-7-15)29(26,27)24-16-11-13(21)10-14(22)12-16/h2-12,24H,1H3,(H,23,25)
InChIKeyRXCYZQRLCYHMFP-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-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2,3-dimethoxybenzamide
CID 17069604
2-methoxy-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 1226628
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-fluorobenzamide
CID 17069483
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-iodobenzamide
CID 126415096
(2S)-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-(2-methoxyphenoxy)propanamide
CID 29418557
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
N-[4-(acetylsulfamoyl)phenyl]-2-methoxybenzamide
CID 803307
2-methoxy-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]benzamide
CID 3563880
2-chloro-5-[(4-fluorophenyl)sulfamoyl]-N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 2332788
1-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-3-(3,4-dimethoxyphenyl)thiourea
CID 19680002
2-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylsulfamoyl)phenyl]benzamide
CID 8000793
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide?
The IUPAC name of N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide (CID 4529855) is N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1.
What is the InChIKey of N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide?
The InChIKey is RXCYZQRLCYHMFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N2O4S/c1-28-19-5-3-2-4-18(19)20(25)23-15-6-8-17(9-7-15)29(26,27)24-16-11-13(21)10-14(22)12-16/h2-12,24H,1H3,(H,23,25).
What are the key properties of N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide?
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-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-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-methoxybenzamide is sourced from PubChem (CID 4529855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).