4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide

C13H9Br2NO2 — CID 3482679

IUPAC4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccc(O)c(Br)c1)c1ccc(Br)cc1
InChIInChI=1S/C13H9Br2NO2/c14-9-3-1-8(2-4-9)13(18)16-10-5-6-12(17)11(15)7-10/h1-7,17H,(H,16,18)
InChIKeyNHJDTUGGWHIVOI-UHFFFAOYSA-N
MW371.03 g/mol
LogP4.17
Rot. Bonds2

About 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide

4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide (PubChem CID 3482679) has the molecular formula C13H9Br2NO2 and a molecular weight of 371.03 g/mol. Its IUPAC name is 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide
PubChem CID3482679
Molecular FormulaC13H9Br2NO2
Molecular Weight371.03 g/mol
Exact Mass368.90
IUPAC Name4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccc(O)c(Br)c1)c1ccc(Br)cc1
InChIInChI=1S/C13H9Br2NO2/c14-9-3-1-8(2-4-9)13(18)16-10-5-6-12(17)11(15)7-10/h1-7,17H,(H,16,18)
InChIKeyNHJDTUGGWHIVOI-UHFFFAOYSA-N
XLogP4.17
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.03
LogP ≤ 54.17
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

N-(2,1,3-benzothiadiazol-5-yl)-4-bromobenzamide
CID 26823481
N-(4-bromophenyl)-4-hydroxy-3-methoxybenzamide
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4-bromo-N-[4-(carbamoylamino)phenyl]benzamide
CID 33151789
4-bromo-N-(4-hydroxy-3,5-dimethylphenyl)benzamide
CID 5241422
N-(3-amino-4-fluorophenyl)-4-bromobenzamide
CID 16777540
potassium 4-[(4-bromobenzoyl)amino]benzoate
CID 144812194
N-[4-[(4-bromobenzoyl)amino]phenyl]-3,4-dichlorobenzamide
CID 21211970
4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
CID 732526
4-[4-[(4-bromophenyl)carbamoyl]phenyl]benzoic acid
CID 155193999
N-(4-bromophenyl)-4-phenylbenzamide
CID 1081912
N-[3-[(4-bromobenzoyl)amino]phenyl]-4-tert-butylbenzamide
CID 3100149
3,5-dibromo-N-(3-chloro-4-hydroxyphenyl)benzamide
CID 107972808

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide?
The IUPAC name of 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide (CID 3482679) is 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide?
The canonical SMILES for 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide is O=C(Nc1ccc(O)c(Br)c1)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide?
The InChIKey is NHJDTUGGWHIVOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2NO2/c14-9-3-1-8(2-4-9)13(18)16-10-5-6-12(17)11(15)7-10/h1-7,17H,(H,16,18).
What are the key properties of 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide?
4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide has a molecular weight of 371.03 g/mol, XLogP of 4.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-bromo-4-hydroxyphenyl)benzamide is sourced from PubChem (CID 3482679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).