5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol

C19H12ClFN2O — CID 163234162

IUPAC5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol
SMILESOc1cc(-n2ncc3cc(-c4ccccc4Cl)ccc32)ccc1F
InChIInChI=1S/C19H12ClFN2O/c20-16-4-2-1-3-15(16)12-5-8-18-13(9-12)11-22-23(18)14-6-7-17(21)19(24)10-14/h1-11,24H
InChIKeyBQMKAQLNBWGNEZ-UHFFFAOYSA-N
MW338.77 g/mol
LogP5.19
Rot. Bonds2

About 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol

5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol (PubChem CID 163234162) has the molecular formula C19H12ClFN2O and a molecular weight of 338.77 g/mol. Its IUPAC name is 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol.

Molecular Properties

Compound Name5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol
PubChem CID163234162
Molecular FormulaC19H12ClFN2O
Molecular Weight338.77 g/mol
Exact Mass338.06
IUPAC Name5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol
SMILESOc1cc(-n2ncc3cc(-c4ccccc4Cl)ccc32)ccc1F
InChIInChI=1S/C19H12ClFN2O/c20-16-4-2-1-3-15(16)12-5-8-18-13(9-12)11-22-23(18)14-6-7-17(21)19(24)10-14/h1-11,24H
InChIKeyBQMKAQLNBWGNEZ-UHFFFAOYSA-N
XLogP5.19
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.77
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol 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 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol?
The IUPAC name of 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol (CID 163234162) is 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol.
What is the SMILES notation for 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol?
The canonical SMILES for 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol is Oc1cc(-n2ncc3cc(-c4ccccc4Cl)ccc32)ccc1F.
What is the InChIKey of 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol?
The InChIKey is BQMKAQLNBWGNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClFN2O/c20-16-4-2-1-3-15(16)12-5-8-18-13(9-12)11-22-23(18)14-6-7-17(21)19(24)10-14/h1-11,24H.
What are the key properties of 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol?
5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol has a molecular weight of 338.77 g/mol, XLogP of 5.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(2-chlorophenyl)indazol-1-yl]-2-fluorophenol is sourced from PubChem (CID 163234162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).