7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol

C15H9F2NO3S — CID 122440001

IUPAC7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol
SMILESO=S(=O)(c1ccc(F)cc1)c1cc(F)c(O)c2ncccc12
InChIInChI=1S/C15H9F2NO3S/c16-9-3-5-10(6-4-9)22(20,21)13-8-12(17)15(19)14-11(13)2-1-7-18-14/h1-8,19H
InChIKeyQIABZCVRDQQJKB-UHFFFAOYSA-N
MW321.30 g/mol
LogP3.05
Rot. Bonds2

About 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol

7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol (PubChem CID 122440001) has the molecular formula C15H9F2NO3S and a molecular weight of 321.30 g/mol. Its IUPAC name is 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol.

Molecular Properties

Compound Name7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol
PubChem CID122440001
Molecular FormulaC15H9F2NO3S
Molecular Weight321.30 g/mol
Exact Mass321.03
IUPAC Name7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol
SMILESO=S(=O)(c1ccc(F)cc1)c1cc(F)c(O)c2ncccc12
InChIInChI=1S/C15H9F2NO3S/c16-9-3-5-10(6-4-9)22(20,21)13-8-12(17)15(19)14-11(13)2-1-7-18-14/h1-8,19H
InChIKeyQIABZCVRDQQJKB-UHFFFAOYSA-N
XLogP3.05
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol?
The IUPAC name of 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol (CID 122440001) is 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol.
What is the SMILES notation for 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol?
The canonical SMILES for 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol is O=S(=O)(c1ccc(F)cc1)c1cc(F)c(O)c2ncccc12.
What is the InChIKey of 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol?
The InChIKey is QIABZCVRDQQJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F2NO3S/c16-9-3-5-10(6-4-9)22(20,21)13-8-12(17)15(19)14-11(13)2-1-7-18-14/h1-8,19H.
What are the key properties of 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol?
7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol has a molecular weight of 321.30 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-(4-fluorophenyl)sulfonylquinolin-8-ol is sourced from PubChem (CID 122440001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).