2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine

C20H13F2NO2S — CID 20911986

IUPAC2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine
SMILESO=S(=O)(c1ccc(F)cc1)c1c(-c2ccc(F)cc2)cn2ccccc12
InChIInChI=1S/C20H13F2NO2S/c21-15-6-4-14(5-7-15)18-13-23-12-2-1-3-19(23)20(18)26(24,25)17-10-8-16(22)9-11-17/h1-13H
InChIKeyOODLVKGDLZTVPX-UHFFFAOYSA-N
MW369.39 g/mol
LogP4.72
Rot. Bonds3

About 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine

2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine (PubChem CID 20911986) has the molecular formula C20H13F2NO2S and a molecular weight of 369.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine
PubChem CID20911986
Molecular FormulaC20H13F2NO2S
Molecular Weight369.39 g/mol
Exact Mass369.06
IUPAC Name2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine
SMILESO=S(=O)(c1ccc(F)cc1)c1c(-c2ccc(F)cc2)cn2ccccc12
InChIInChI=1S/C20H13F2NO2S/c21-15-6-4-14(5-7-15)18-13-23-12-2-1-3-19(23)20(18)26(24,25)17-10-8-16(22)9-11-17/h1-13H
InChIKeyOODLVKGDLZTVPX-UHFFFAOYSA-N
XLogP4.72
TPSA38.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine?
The IUPAC name of 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine (CID 20911986) is 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine?
The canonical SMILES for 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine is O=S(=O)(c1ccc(F)cc1)c1c(-c2ccc(F)cc2)cn2ccccc12.
What is the InChIKey of 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine?
The InChIKey is OODLVKGDLZTVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2NO2S/c21-15-6-4-14(5-7-15)18-13-23-12-2-1-3-19(23)20(18)26(24,25)17-10-8-16(22)9-11-17/h1-13H.
What are the key properties of 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine?
2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine has a molecular weight of 369.39 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine is sourced from PubChem (CID 20911986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).