[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone

C23H14N2O3 — CID 1037240

IUPAC[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1
InChIInChI=1S/C23H14N2O3/c26-23(15-6-2-1-3-7-15)16-10-11-17-18(14-16)25-22(20-9-5-13-28-20)21(24-17)19-8-4-12-27-19/h1-14H
InChIKeyJMIHJEGISAXHQH-UHFFFAOYSA-N
MW366.38 g/mol
LogP5.38
Rot. Bonds4

About [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone

[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone (PubChem CID 1037240) has the molecular formula C23H14N2O3 and a molecular weight of 366.38 g/mol. Its IUPAC name is [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone.

Molecular Properties

Compound Name[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone
PubChem CID1037240
Molecular FormulaC23H14N2O3
Molecular Weight366.38 g/mol
Exact Mass366.10
IUPAC Name[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1
InChIInChI=1S/C23H14N2O3/c26-23(15-6-2-1-3-7-15)16-10-11-17-18(14-16)25-22(20-9-5-13-28-20)21(24-17)19-8-4-12-27-19/h1-14H
InChIKeyJMIHJEGISAXHQH-UHFFFAOYSA-N
XLogP5.38
TPSA69.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.38
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone?
The IUPAC name of [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone (CID 1037240) is [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone.
What is the SMILES notation for [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone?
The canonical SMILES for [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone is O=C(c1ccccc1)c1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1.
What is the InChIKey of [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone?
The InChIKey is JMIHJEGISAXHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14N2O3/c26-23(15-6-2-1-3-7-15)16-10-11-17-18(14-16)25-22(20-9-5-13-28-20)21(24-17)19-8-4-12-27-19/h1-14H.
What are the key properties of [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone?
[2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone has a molecular weight of 366.38 g/mol, XLogP of 5.38, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-bis(furan-2-yl)quinoxalin-6-yl]-phenylmethanone is sourced from PubChem (CID 1037240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).