2-(5-oxobenzo[b]phosphindol-5-yl)phenol

C18H13O2P — CID 121248397

IUPAC2-(5-oxobenzo[b]phosphindol-5-yl)phenol
SMILESO=P1(c2ccccc2O)c2ccccc2-c2ccccc21
InChIInChI=1S/C18H13O2P/c19-15-9-3-6-12-18(15)21(20)16-10-4-1-7-13(16)14-8-2-5-11-17(14)21/h1-12,19H
InChIKeyYQZKATFSMLHGFH-UHFFFAOYSA-N
MW292.27 g/mol
LogP3.01
Rot. Bonds1

About 2-(5-oxobenzo[b]phosphindol-5-yl)phenol

2-(5-oxobenzo[b]phosphindol-5-yl)phenol (PubChem CID 121248397) has the molecular formula C18H13O2P and a molecular weight of 292.27 g/mol. Its IUPAC name is 2-(5-oxobenzo[b]phosphindol-5-yl)phenol.

Molecular Properties

Compound Name2-(5-oxobenzo[b]phosphindol-5-yl)phenol
PubChem CID121248397
Molecular FormulaC18H13O2P
Molecular Weight292.27 g/mol
Exact Mass292.07
IUPAC Name2-(5-oxobenzo[b]phosphindol-5-yl)phenol
SMILESO=P1(c2ccccc2O)c2ccccc2-c2ccccc21
InChIInChI=1S/C18H13O2P/c19-15-9-3-6-12-18(15)21(20)16-10-4-1-7-13(16)14-8-2-5-11-17(14)21/h1-12,19H
InChIKeyYQZKATFSMLHGFH-UHFFFAOYSA-N
XLogP3.01
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.27
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(5-oxobenzo[b]phosphindol-5-yl)phenol 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-(5-oxobenzo[b]phosphindol-5-yl)phenol?
The IUPAC name of 2-(5-oxobenzo[b]phosphindol-5-yl)phenol (CID 121248397) is 2-(5-oxobenzo[b]phosphindol-5-yl)phenol.
What is the SMILES notation for 2-(5-oxobenzo[b]phosphindol-5-yl)phenol?
The canonical SMILES for 2-(5-oxobenzo[b]phosphindol-5-yl)phenol is O=P1(c2ccccc2O)c2ccccc2-c2ccccc21.
What is the InChIKey of 2-(5-oxobenzo[b]phosphindol-5-yl)phenol?
The InChIKey is YQZKATFSMLHGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13O2P/c19-15-9-3-6-12-18(15)21(20)16-10-4-1-7-13(16)14-8-2-5-11-17(14)21/h1-12,19H.
What are the key properties of 2-(5-oxobenzo[b]phosphindol-5-yl)phenol?
2-(5-oxobenzo[b]phosphindol-5-yl)phenol has a molecular weight of 292.27 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-oxobenzo[b]phosphindol-5-yl)phenol is sourced from PubChem (CID 121248397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).