5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide

C14H9BrCl2N2O2 — CID 103763706

IUPAC5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
SMILESNC(=O)c1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl
InChIInChI=1S/C14H9BrCl2N2O2/c15-11-5-7(16)1-3-9(11)14(21)19-8-2-4-12(17)10(6-8)13(18)20/h1-6H,(H2,18,20)(H,19,21)
InChIKeyJLUXCWVENXVGJC-UHFFFAOYSA-N
MW388.05 g/mol
LogP4.11
Rot. Bonds3

About 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide

5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide (PubChem CID 103763706) has the molecular formula C14H9BrCl2N2O2 and a molecular weight of 388.05 g/mol. Its IUPAC name is 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide.

Molecular Properties

Compound Name5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
PubChem CID103763706
Molecular FormulaC14H9BrCl2N2O2
Molecular Weight388.05 g/mol
Exact Mass385.92
IUPAC Name5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
SMILESNC(=O)c1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl
InChIInChI=1S/C14H9BrCl2N2O2/c15-11-5-7(16)1-3-9(11)14(21)19-8-2-4-12(17)10(6-8)13(18)20/h1-6H,(H2,18,20)(H,19,21)
InChIKeyJLUXCWVENXVGJC-UHFFFAOYSA-N
XLogP4.11
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.05
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide?
The IUPAC name of 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide (CID 103763706) is 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide.
What is the SMILES notation for 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide?
The canonical SMILES for 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide is NC(=O)c1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl.
What is the InChIKey of 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide?
The InChIKey is JLUXCWVENXVGJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrCl2N2O2/c15-11-5-7(16)1-3-9(11)14(21)19-8-2-4-12(17)10(6-8)13(18)20/h1-6H,(H2,18,20)(H,19,21).
What are the key properties of 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide?
5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide has a molecular weight of 388.05 g/mol, XLogP of 4.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide is sourced from PubChem (CID 103763706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).