2,3-bis(2,4-difluorophenoxy)quinoxaline

C20H10F4N2O2 — CID 1040546

IUPAC2,3-bis(2,4-difluorophenoxy)quinoxaline
SMILESFc1ccc(Oc2nc3ccccc3nc2Oc2ccc(F)cc2F)c(F)c1
InChIInChI=1S/C20H10F4N2O2/c21-11-5-7-17(13(23)9-11)27-19-20(26-16-4-2-1-3-15(16)25-19)28-18-8-6-12(22)10-14(18)24/h1-10H
InChIKeyHSLFWNNXHMEYOQ-UHFFFAOYSA-N
MW386.30 g/mol
LogP5.77
Rot. Bonds4

About 2,3-bis(2,4-difluorophenoxy)quinoxaline

2,3-bis(2,4-difluorophenoxy)quinoxaline (PubChem CID 1040546) has the molecular formula C20H10F4N2O2 and a molecular weight of 386.30 g/mol. Its IUPAC name is 2,3-bis(2,4-difluorophenoxy)quinoxaline.

Molecular Properties

Compound Name2,3-bis(2,4-difluorophenoxy)quinoxaline
PubChem CID1040546
Molecular FormulaC20H10F4N2O2
Molecular Weight386.30 g/mol
Exact Mass386.07
IUPAC Name2,3-bis(2,4-difluorophenoxy)quinoxaline
SMILESFc1ccc(Oc2nc3ccccc3nc2Oc2ccc(F)cc2F)c(F)c1
InChIInChI=1S/C20H10F4N2O2/c21-11-5-7-17(13(23)9-11)27-19-20(26-16-4-2-1-3-15(16)25-19)28-18-8-6-12(22)10-14(18)24/h1-10H
InChIKeyHSLFWNNXHMEYOQ-UHFFFAOYSA-N
XLogP5.77
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.30
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(2,4-difluorophenoxy)quinoxaline?
The IUPAC name of 2,3-bis(2,4-difluorophenoxy)quinoxaline (CID 1040546) is 2,3-bis(2,4-difluorophenoxy)quinoxaline.
What is the SMILES notation for 2,3-bis(2,4-difluorophenoxy)quinoxaline?
The canonical SMILES for 2,3-bis(2,4-difluorophenoxy)quinoxaline is Fc1ccc(Oc2nc3ccccc3nc2Oc2ccc(F)cc2F)c(F)c1.
What is the InChIKey of 2,3-bis(2,4-difluorophenoxy)quinoxaline?
The InChIKey is HSLFWNNXHMEYOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10F4N2O2/c21-11-5-7-17(13(23)9-11)27-19-20(26-16-4-2-1-3-15(16)25-19)28-18-8-6-12(22)10-14(18)24/h1-10H.
What are the key properties of 2,3-bis(2,4-difluorophenoxy)quinoxaline?
2,3-bis(2,4-difluorophenoxy)quinoxaline has a molecular weight of 386.30 g/mol, XLogP of 5.77, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(2,4-difluorophenoxy)quinoxaline is sourced from PubChem (CID 1040546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).