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

C13H7Cl4NO2 — CID 82885265

IUPAC3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1cc(Cl)c(O)c(Cl)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H7Cl4NO2/c14-8-2-1-6(3-9(8)15)13(20)18-7-4-10(16)12(19)11(17)5-7/h1-5,19H,(H,18,20)
InChIKeyZFNCTJVNSJZKCF-UHFFFAOYSA-N
MW351.02 g/mol
LogP5.26
Rot. Bonds2

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

3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide (PubChem CID 82885265) has the molecular formula C13H7Cl4NO2 and a molecular weight of 351.02 g/mol. Its IUPAC name is 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
PubChem CID82885265
Molecular FormulaC13H7Cl4NO2
Molecular Weight351.02 g/mol
Exact Mass348.92
IUPAC Name3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1cc(Cl)c(O)c(Cl)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H7Cl4NO2/c14-8-2-1-6(3-9(8)15)13(20)18-7-4-10(16)12(19)11(17)5-7/h1-5,19H,(H,18,20)
InChIKeyZFNCTJVNSJZKCF-UHFFFAOYSA-N
XLogP5.26
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.02
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 5119664
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
4-(chloromethyl)-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 107679537
N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 1254136
N-(3,5-dichloro-4-hydroxyphenyl)-3-fluorobenzamide
CID 82885015
N-(3,5-dichloro-4-hydroxyphenyl)-1,3-dihydro-2-benzofuran-5-carboxamide
CID 82881373
N-[4-[(4-bromobenzoyl)amino]phenyl]-3,4-dichlorobenzamide
CID 21211970
4-amino-N-(3,4-dichlorophenyl)-3-hydroxybenzamide
CID 107073884
3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide
CID 624416
3,5-dibromo-N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybenzamide
CID 169122474
3,4-dichloro-N-(3,4-dimethylphenyl)benzamide
CID 677956
N-(3,5-dichloro-4-hydroxyphenyl)-5-hydroxypyridine-3-carboxamide
CID 82884651

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide?
The IUPAC name of 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide (CID 82885265) is 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide.
What is the SMILES notation for 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide?
The canonical SMILES for 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide is O=C(Nc1cc(Cl)c(O)c(Cl)c1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide?
The InChIKey is ZFNCTJVNSJZKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl4NO2/c14-8-2-1-6(3-9(8)15)13(20)18-7-4-10(16)12(19)11(17)5-7/h1-5,19H,(H,18,20).
What are the key properties of 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide?
3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide has a molecular weight of 351.02 g/mol, XLogP of 5.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide is sourced from PubChem (CID 82885265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).