2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide

C19H14Cl2N2O3S — CID 2983086

IUPAC2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C19H14Cl2N2O3S/c20-16-11-10-13(12-17(16)21)22-19(24)15-8-4-5-9-18(15)23-27(25,26)14-6-2-1-3-7-14/h1-12,23H,(H,22,24)
InChIKeyQXSVXLDPDYIOQW-UHFFFAOYSA-N
MW421.31 g/mol
LogP5.05
Rot. Bonds5

About 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide

2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide (PubChem CID 2983086) has the molecular formula C19H14Cl2N2O3S and a molecular weight of 421.31 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide
PubChem CID2983086
Molecular FormulaC19H14Cl2N2O3S
Molecular Weight421.31 g/mol
Exact Mass420.01
IUPAC Name2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C19H14Cl2N2O3S/c20-16-11-10-13(12-17(16)21)22-19(24)15-8-4-5-9-18(15)23-27(25,26)14-6-2-1-3-7-14/h1-12,23H,(H,22,24)
InChIKeyQXSVXLDPDYIOQW-UHFFFAOYSA-N
XLogP5.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.31
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide?
The IUPAC name of 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide (CID 2983086) is 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide.
What is the SMILES notation for 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide?
The canonical SMILES for 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide?
The InChIKey is QXSVXLDPDYIOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N2O3S/c20-16-11-10-13(12-17(16)21)22-19(24)15-8-4-5-9-18(15)23-27(25,26)14-6-2-1-3-7-14/h1-12,23H,(H,22,24).
What are the key properties of 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide?
2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide has a molecular weight of 421.31 g/mol, XLogP of 5.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-N-(3,4-dichlorophenyl)benzamide is sourced from PubChem (CID 2983086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).