1-(2,4-difluorophenyl)sulfonylindol-5-ol

C14H9F2NO3S — CID 3263399

IUPAC1-(2,4-difluorophenyl)sulfonylindol-5-ol
SMILESO=S(=O)(c1ccc(F)cc1F)n1ccc2cc(O)ccc21
InChIInChI=1S/C14H9F2NO3S/c15-10-1-4-14(12(16)8-10)21(19,20)17-6-5-9-7-11(18)2-3-13(9)17/h1-8,18H
InChIKeyRVSIDWWXRYZMDB-UHFFFAOYSA-N
MW309.29 g/mol
LogP2.86
Rot. Bonds2

About 1-(2,4-difluorophenyl)sulfonylindol-5-ol

1-(2,4-difluorophenyl)sulfonylindol-5-ol (PubChem CID 3263399) has the molecular formula C14H9F2NO3S and a molecular weight of 309.29 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)sulfonylindol-5-ol.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)sulfonylindol-5-ol
PubChem CID3263399
Molecular FormulaC14H9F2NO3S
Molecular Weight309.29 g/mol
Exact Mass309.03
IUPAC Name1-(2,4-difluorophenyl)sulfonylindol-5-ol
SMILESO=S(=O)(c1ccc(F)cc1F)n1ccc2cc(O)ccc21
InChIInChI=1S/C14H9F2NO3S/c15-10-1-4-14(12(16)8-10)21(19,20)17-6-5-9-7-11(18)2-3-13(9)17/h1-8,18H
InChIKeyRVSIDWWXRYZMDB-UHFFFAOYSA-N
XLogP2.86
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)sulfonylindol-5-ol?
The IUPAC name of 1-(2,4-difluorophenyl)sulfonylindol-5-ol (CID 3263399) is 1-(2,4-difluorophenyl)sulfonylindol-5-ol.
What is the SMILES notation for 1-(2,4-difluorophenyl)sulfonylindol-5-ol?
The canonical SMILES for 1-(2,4-difluorophenyl)sulfonylindol-5-ol is O=S(=O)(c1ccc(F)cc1F)n1ccc2cc(O)ccc21.
What is the InChIKey of 1-(2,4-difluorophenyl)sulfonylindol-5-ol?
The InChIKey is RVSIDWWXRYZMDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2NO3S/c15-10-1-4-14(12(16)8-10)21(19,20)17-6-5-9-7-11(18)2-3-13(9)17/h1-8,18H.
What are the key properties of 1-(2,4-difluorophenyl)sulfonylindol-5-ol?
1-(2,4-difluorophenyl)sulfonylindol-5-ol has a molecular weight of 309.29 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)sulfonylindol-5-ol is sourced from PubChem (CID 3263399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).