4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide

C13H7Br2Cl2NO — CID 81271772

IUPAC4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide
SMILESO=C(Nc1cc(Cl)ccc1Br)c1ccc(Br)cc1Cl
InChIInChI=1S/C13H7Br2Cl2NO/c14-7-1-3-9(11(17)5-7)13(19)18-12-6-8(16)2-4-10(12)15/h1-6H,(H,18,19)
InChIKeyLDSRFDBCAMTARW-UHFFFAOYSA-N
MW423.92 g/mol
LogP5.77
Rot. Bonds2

About 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide

4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide (PubChem CID 81271772) has the molecular formula C13H7Br2Cl2NO and a molecular weight of 423.92 g/mol. Its IUPAC name is 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide.

Molecular Properties

Compound Name4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide
PubChem CID81271772
Molecular FormulaC13H7Br2Cl2NO
Molecular Weight423.92 g/mol
Exact Mass420.83
IUPAC Name4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide
SMILESO=C(Nc1cc(Cl)ccc1Br)c1ccc(Br)cc1Cl
InChIInChI=1S/C13H7Br2Cl2NO/c14-7-1-3-9(11(17)5-7)13(19)18-12-6-8(16)2-4-10(12)15/h1-6H,(H,18,19)
InChIKeyLDSRFDBCAMTARW-UHFFFAOYSA-N
XLogP5.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.92
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389
2-[(4-bromo-2-chlorobenzoyl)amino]-4-chlorobenzoic acid
CID 43805401
2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
CID 113257224
5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
CID 62247491
N-(2-bromo-5-chlorophenyl)-2-chloro-5-hydroxybenzamide
CID 106501145
N-(2-bromo-5-chlorophenyl)-2-chloro-5-sulfanylbenzamide
CID 107033057
N-(2-bromo-5-chlorophenyl)-4-chloropyridine-3-carboxamide
CID 81263935
2-amino-4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 79715050
N-(2-amino-5-chlorophenyl)-2,5-dibromobenzamide
CID 114367618
N-(4-bromo-2-carbamothioylphenyl)-2,4-dichlorobenzamide
CID 82695357
2-chloro-N-(2,5-dibromophenyl)-5-hydroxybenzamide
CID 106501529
2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
CID 81270262

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide?
The IUPAC name of 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide (CID 81271772) is 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide.
What is the SMILES notation for 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide?
The canonical SMILES for 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide is O=C(Nc1cc(Cl)ccc1Br)c1ccc(Br)cc1Cl.
What is the InChIKey of 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide?
The InChIKey is LDSRFDBCAMTARW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Br2Cl2NO/c14-7-1-3-9(11(17)5-7)13(19)18-12-6-8(16)2-4-10(12)15/h1-6H,(H,18,19).
What are the key properties of 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide?
4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide has a molecular weight of 423.92 g/mol, XLogP of 5.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide is sourced from PubChem (CID 81271772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).