2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline

C14H10N2O2S — CID 141358089

IUPAC2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline
SMILESc1ccc2nc(-c3scc4c3OCCO4)cnc2c1
InChIInChI=1S/C14H10N2O2S/c1-2-4-10-9(3-1)15-7-11(16-10)14-13-12(8-19-14)17-5-6-18-13/h1-4,7-8H,5-6H2
InChIKeyKBKVPLPJMVRUFK-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.13
Rot. Bonds1

About 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline

2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline (PubChem CID 141358089) has the molecular formula C14H10N2O2S and a molecular weight of 270.31 g/mol. Its IUPAC name is 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline.

Molecular Properties

Compound Name2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline
PubChem CID141358089
Molecular FormulaC14H10N2O2S
Molecular Weight270.31 g/mol
Exact Mass270.05
IUPAC Name2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline
SMILESc1ccc2nc(-c3scc4c3OCCO4)cnc2c1
InChIInChI=1S/C14H10N2O2S/c1-2-4-10-9(3-1)15-7-11(16-10)14-13-12(8-19-14)17-5-6-18-13/h1-4,7-8H,5-6H2
InChIKeyKBKVPLPJMVRUFK-UHFFFAOYSA-N
XLogP3.13
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline?
The IUPAC name of 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline (CID 141358089) is 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline.
What is the SMILES notation for 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline?
The canonical SMILES for 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline is c1ccc2nc(-c3scc4c3OCCO4)cnc2c1.
What is the InChIKey of 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline?
The InChIKey is KBKVPLPJMVRUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2S/c1-2-4-10-9(3-1)15-7-11(16-10)14-13-12(8-19-14)17-5-6-18-13/h1-4,7-8H,5-6H2.
What are the key properties of 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline?
2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline has a molecular weight of 270.31 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)quinoxaline is sourced from PubChem (CID 141358089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).