2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide

C11H14Br2N2O3S — CID 103882820

IUPAC2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide
SMILESCCNS(=O)(=O)CCNC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C11H14Br2N2O3S/c1-2-15-19(17,18)6-5-14-11(16)9-4-3-8(12)7-10(9)13/h3-4,7,15H,2,5-6H2,1H3,(H,14,16)
InChIKeyBGOKCINWGMAEMY-UHFFFAOYSA-N
MW414.12 g/mol
LogP1.88
Rot. Bonds6

About 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide

2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide (PubChem CID 103882820) has the molecular formula C11H14Br2N2O3S and a molecular weight of 414.12 g/mol. Its IUPAC name is 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound Name2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide
PubChem CID103882820
Molecular FormulaC11H14Br2N2O3S
Molecular Weight414.12 g/mol
Exact Mass411.91
IUPAC Name2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide
SMILESCCNS(=O)(=O)CCNC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C11H14Br2N2O3S/c1-2-15-19(17,18)6-5-14-11(16)9-4-3-8(12)7-10(9)13/h3-4,7,15H,2,5-6H2,1H3,(H,14,16)
InChIKeyBGOKCINWGMAEMY-UHFFFAOYSA-N
XLogP1.88
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.12
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[2-(ethylsulfamoyl)ethyl]-5-nitrobenzamide
CID 106336133
2,4-dibromo-N-(2-methoxyethyl)benzamide
CID 103882043
2-bromo-4-[2-(ethylsulfamoyl)ethylamino]benzoic acid
CID 114176009
2,4-dibromo-N-(2-bromoethyl)benzamide
CID 107941215
5-bromo-N-[2-(ethylsulfamoyl)ethyl]pyridine-3-carboxamide
CID 113233794
N-[2-(ethylsulfamoyl)ethyl]-2-hydroxy-4-methoxybenzamide
CID 56785842
N-[2-(ethylsulfamoyl)ethyl]-4-hydrazinyl-2-methylbenzamide
CID 106340923
N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinyl-5-methylbenzamide
CID 106340904
2,4-dibromo-N-(3-ethoxypropyl)benzamide
CID 103882188
2,4-dibromo-N-[2-[methyl(propan-2-yl)amino]ethyl]benzamide
CID 103882713
N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylbenzamide
CID 106340919
2,4-dibromo-N-pent-3-ynylbenzamide
CID 104581244

Frequently Asked Questions

What is the IUPAC name of 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide?
The IUPAC name of 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide (CID 103882820) is 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide?
The canonical SMILES for 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide is CCNS(=O)(=O)CCNC(=O)c1ccc(Br)cc1Br.
What is the InChIKey of 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide?
The InChIKey is BGOKCINWGMAEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Br2N2O3S/c1-2-15-19(17,18)6-5-14-11(16)9-4-3-8(12)7-10(9)13/h3-4,7,15H,2,5-6H2,1H3,(H,14,16).
What are the key properties of 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide?
2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide has a molecular weight of 414.12 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-N-[2-(ethylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 103882820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).