N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide

C15H11BrCl2N2O2 — CID 108500869

IUPACN'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2cccc(Cl)c2Cl)c(Br)c1
InChIInChI=1S/C15H11BrCl2N2O2/c1-8-5-6-11(9(16)7-8)19-14(21)15(22)20-12-4-2-3-10(17)13(12)18/h2-7H,1H3,(H,19,21)(H,20,22)
InChIKeyGFKBDTCFNOMBDT-UHFFFAOYSA-N
MW402.08 g/mol
LogP4.64
Rot. Bonds2

About N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide

N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide (PubChem CID 108500869) has the molecular formula C15H11BrCl2N2O2 and a molecular weight of 402.08 g/mol. Its IUPAC name is N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide.

Molecular Properties

Compound NameN'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide
PubChem CID108500869
Molecular FormulaC15H11BrCl2N2O2
Molecular Weight402.08 g/mol
Exact Mass399.94
IUPAC NameN'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2cccc(Cl)c2Cl)c(Br)c1
InChIInChI=1S/C15H11BrCl2N2O2/c1-8-5-6-11(9(16)7-8)19-14(21)15(22)20-12-4-2-3-10(17)13(12)18/h2-7H,1H3,(H,19,21)(H,20,22)
InChIKeyGFKBDTCFNOMBDT-UHFFFAOYSA-N
XLogP4.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.08
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromo-4-methylphenyl)-2-(2,6-dichlorophenyl)acetamide
CID 2707551
N-(2-bromo-4-methylphenyl)-N'-(2-ethylphenyl)oxamide
CID 108530383
N-(2-bromo-4-methylphenyl)-N'-(5-chloro-2-methylphenyl)oxamide
CID 108511860
N-(2-bromo-4-methylphenyl)-2-(4-methylphenyl)-2-oxoacetamide
CID 47121268
N-(2-bromo-4-methylphenyl)-3-chloro-2-fluorobenzamide
CID 81004240
2-amino-N-(2,3-dichlorophenyl)-5-methylbenzamide
CID 62509307
N'-(3-acetylphenyl)-N-(2-bromo-4-methylphenyl)oxamide
CID 108515070
N'-benzhydryl-N-(2-bromo-4-methylphenyl)oxamide
CID 108508121
N-(2-bromo-4-methylphenyl)-N'-tert-butyloxamide
CID 108506932
1-(2-bromo-4-methylphenyl)-3-(3-chlorophenyl)urea
CID 4549529
N-(2-bromo-4-methylphenyl)-N'-(2-butan-2-ylphenyl)oxamide
CID 108532602
N-(2-bromo-4-chlorophenyl)-2,3-dichlorobenzamide
CID 81028936

Frequently Asked Questions

What is the IUPAC name of N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide?
The IUPAC name of N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide (CID 108500869) is N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide.
What is the SMILES notation for N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide?
The canonical SMILES for N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2cccc(Cl)c2Cl)c(Br)c1.
What is the InChIKey of N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide?
The InChIKey is GFKBDTCFNOMBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrCl2N2O2/c1-8-5-6-11(9(16)7-8)19-14(21)15(22)20-12-4-2-3-10(17)13(12)18/h2-7H,1H3,(H,19,21)(H,20,22).
What are the key properties of N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide?
N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide has a molecular weight of 402.08 g/mol, XLogP of 4.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-bromo-4-methylphenyl)-N-(2,3-dichlorophenyl)oxamide is sourced from PubChem (CID 108500869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).