2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide

C13H7Br2Cl2NO2 — CID 5119267

IUPAC2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1cc(Br)c(O)c(Br)c1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H7Br2Cl2NO2/c14-9-4-7(5-10(15)12(9)19)18-13(20)8-3-6(16)1-2-11(8)17/h1-5,19H,(H,18,20)
InChIKeyIFLWCZRMFPKYBN-UHFFFAOYSA-N
MW439.92 g/mol
LogP5.48
Rot. Bonds2

About 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide

2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide (PubChem CID 5119267) has the molecular formula C13H7Br2Cl2NO2 and a molecular weight of 439.92 g/mol. Its IUPAC name is 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide
PubChem CID5119267
Molecular FormulaC13H7Br2Cl2NO2
Molecular Weight439.92 g/mol
Exact Mass436.82
IUPAC Name2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1cc(Br)c(O)c(Br)c1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H7Br2Cl2NO2/c14-9-4-7(5-10(15)12(9)19)18-13(20)8-3-6(16)1-2-11(8)17/h1-5,19H,(H,18,20)
InChIKeyIFLWCZRMFPKYBN-UHFFFAOYSA-N
XLogP5.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.92
LogP ≤ 55.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dichloro-N-(3,5-dimethylphenyl)benzamide
CID 965625
N-(4-bromo-3-iodophenyl)-2,5-dichlorobenzamide
CID 114259361
2,5-dichloro-N-(4-chloro-3-hydroxyphenyl)benzamide
CID 64789245
5-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-2-methylbenzamide
CID 82885279
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
2,5-dichloro-N-(3,5-dichloro-2-hydroxyphenyl)benzamide
CID 103891166
N-(4-bromo-3-chlorophenyl)-5-chloro-2-fluorobenzamide
CID 107619744
N-(3-bromo-5-chlorophenyl)-5-chloro-2-hydroxybenzamide
CID 177120584
N-(2-bromo-5-chlorophenyl)-2-chloro-5-hydroxybenzamide
CID 106501145
3,5-dibromo-N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybenzamide
CID 169122474
5-chloro-N-(3,5-dichloro-4-methylphenyl)-2-hydroxybenzamide
CID 167679776
N-(3-amino-4-bromophenyl)-5-chloro-2-hydroxybenzamide
CID 79767581

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide?
The IUPAC name of 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide (CID 5119267) is 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide.
What is the SMILES notation for 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide?
The canonical SMILES for 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide is O=C(Nc1cc(Br)c(O)c(Br)c1)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide?
The InChIKey is IFLWCZRMFPKYBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Br2Cl2NO2/c14-9-4-7(5-10(15)12(9)19)18-13(20)8-3-6(16)1-2-11(8)17/h1-5,19H,(H,18,20).
What are the key properties of 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide?
2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide has a molecular weight of 439.92 g/mol, XLogP of 5.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamide is sourced from PubChem (CID 5119267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).