2,4-dibromo-6-hydroxy-N-phenylbenzamide

C13H9Br2NO2 — CID 101304515

IUPAC2,4-dibromo-6-hydroxy-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1c(O)cc(Br)cc1Br
InChIInChI=1S/C13H9Br2NO2/c14-8-6-10(15)12(11(17)7-8)13(18)16-9-4-2-1-3-5-9/h1-7,17H,(H,16,18)
InChIKeyTYHWNEKEWGHOGN-UHFFFAOYSA-N
MW371.03 g/mol
LogP4.17
Rot. Bonds2

About 2,4-dibromo-6-hydroxy-N-phenylbenzamide

2,4-dibromo-6-hydroxy-N-phenylbenzamide (PubChem CID 101304515) has the molecular formula C13H9Br2NO2 and a molecular weight of 371.03 g/mol. Its IUPAC name is 2,4-dibromo-6-hydroxy-N-phenylbenzamide.

Molecular Properties

Compound Name2,4-dibromo-6-hydroxy-N-phenylbenzamide
PubChem CID101304515
Molecular FormulaC13H9Br2NO2
Molecular Weight371.03 g/mol
Exact Mass368.90
IUPAC Name2,4-dibromo-6-hydroxy-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1c(O)cc(Br)cc1Br
InChIInChI=1S/C13H9Br2NO2/c14-8-6-10(15)12(11(17)7-8)13(18)16-9-4-2-1-3-5-9/h1-7,17H,(H,16,18)
InChIKeyTYHWNEKEWGHOGN-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

Analyze 2,4-dibromo-6-hydroxy-N-phenylbenzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dibromo-6-hydroxy-N-phenylbenzamide?
The IUPAC name of 2,4-dibromo-6-hydroxy-N-phenylbenzamide (CID 101304515) is 2,4-dibromo-6-hydroxy-N-phenylbenzamide.
What is the SMILES notation for 2,4-dibromo-6-hydroxy-N-phenylbenzamide?
The canonical SMILES for 2,4-dibromo-6-hydroxy-N-phenylbenzamide is O=C(Nc1ccccc1)c1c(O)cc(Br)cc1Br.
What is the InChIKey of 2,4-dibromo-6-hydroxy-N-phenylbenzamide?
The InChIKey is TYHWNEKEWGHOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2NO2/c14-8-6-10(15)12(11(17)7-8)13(18)16-9-4-2-1-3-5-9/h1-7,17H,(H,16,18).
What are the key properties of 2,4-dibromo-6-hydroxy-N-phenylbenzamide?
2,4-dibromo-6-hydroxy-N-phenylbenzamide 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 2,4-dibromo-6-hydroxy-N-phenylbenzamide is sourced from PubChem (CID 101304515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).