5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol

C19H12F2N2O — CID 163233211

IUPAC5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol
SMILESOc1cc2c(cnn2-c2ccc(-c3ccccc3F)cc2)cc1F
InChIInChI=1S/C19H12F2N2O/c20-16-4-2-1-3-15(16)12-5-7-14(8-6-12)23-18-10-19(24)17(21)9-13(18)11-22-23/h1-11,24H
InChIKeyQRYRKSLIBJBOKI-UHFFFAOYSA-N
MW322.31 g/mol
LogP4.68
Rot. Bonds2

About 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol

5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol (PubChem CID 163233211) has the molecular formula C19H12F2N2O and a molecular weight of 322.31 g/mol. Its IUPAC name is 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol.

Molecular Properties

Compound Name5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol
PubChem CID163233211
Molecular FormulaC19H12F2N2O
Molecular Weight322.31 g/mol
Exact Mass322.09
IUPAC Name5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol
SMILESOc1cc2c(cnn2-c2ccc(-c3ccccc3F)cc2)cc1F
InChIInChI=1S/C19H12F2N2O/c20-16-4-2-1-3-15(16)12-5-7-14(8-6-12)23-18-10-19(24)17(21)9-13(18)11-22-23/h1-11,24H
InChIKeyQRYRKSLIBJBOKI-UHFFFAOYSA-N
XLogP4.68
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.31
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol?
The IUPAC name of 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol (CID 163233211) is 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol.
What is the SMILES notation for 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol?
The canonical SMILES for 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol is Oc1cc2c(cnn2-c2ccc(-c3ccccc3F)cc2)cc1F.
What is the InChIKey of 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol?
The InChIKey is QRYRKSLIBJBOKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N2O/c20-16-4-2-1-3-15(16)12-5-7-14(8-6-12)23-18-10-19(24)17(21)9-13(18)11-22-23/h1-11,24H.
What are the key properties of 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol?
5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol has a molecular weight of 322.31 g/mol, XLogP of 4.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-[4-(2-fluorophenyl)phenyl]indazol-6-ol is sourced from PubChem (CID 163233211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).