3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide

C14H12Cl2N2O4S — CID 33102554

IUPAC3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide
SMILESCONC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H12Cl2N2O4S/c1-22-17-14(19)9-3-2-4-10(7-9)18-23(20,21)11-5-6-12(15)13(16)8-11/h2-8,18H,1H3,(H,17,19)
InChIKeyLXHVWHNEDSPZMX-UHFFFAOYSA-N
MW375.23 g/mol
LogP3.09
Rot. Bonds5

About 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide

3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide (PubChem CID 33102554) has the molecular formula C14H12Cl2N2O4S and a molecular weight of 375.23 g/mol. Its IUPAC name is 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide.

Molecular Properties

Compound Name3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide
PubChem CID33102554
Molecular FormulaC14H12Cl2N2O4S
Molecular Weight375.23 g/mol
Exact Mass373.99
IUPAC Name3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide
SMILESCONC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H12Cl2N2O4S/c1-22-17-14(19)9-3-2-4-10(7-9)18-23(20,21)11-5-6-12(15)13(16)8-11/h2-8,18H,1H3,(H,17,19)
InChIKeyLXHVWHNEDSPZMX-UHFFFAOYSA-N
XLogP3.09
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.23
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(3,4-dichlorophenyl)sulfonylamino]-N-propan-2-ylbenzamide
CID 27648381
4-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide
CID 18154799
N-(3-acetylphenyl)-3,4-dichlorobenzenesulfonamide
CID 3702970
3-[(3,4-dichlorophenyl)sulfonylamino]benzoic acid
CID 2234493
3-[(3,4-dichlorophenyl)sulfonylamino]-N-propylbenzamide
CID 17495670
N-(2-benzamidoethyl)-3-[(3,4-dichlorophenyl)sulfonylamino]benzamide
CID 24659997
3-[(3,4-dichlorophenyl)sulfonylamino]-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 24635607
3-[(3,4-dichlorophenyl)sulfonylamino]-N-pentylbenzamide
CID 7908049
3,4-dichloro-N-(3-methoxyphenyl)benzenesulfonamide
CID 7745694
N-methoxy-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 33101820
N-(3,4-dichlorophenyl)-3-(hydrazinecarbonyl)benzenesulfonamide
CID 100657146
N-methoxy-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 17421680

Frequently Asked Questions

What is the IUPAC name of 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide?
The IUPAC name of 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide (CID 33102554) is 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide.
What is the SMILES notation for 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide?
The canonical SMILES for 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide is CONC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide?
The InChIKey is LXHVWHNEDSPZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O4S/c1-22-17-14(19)9-3-2-4-10(7-9)18-23(20,21)11-5-6-12(15)13(16)8-11/h2-8,18H,1H3,(H,17,19).
What are the key properties of 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide?
3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide has a molecular weight of 375.23 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide is sourced from PubChem (CID 33102554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).