5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine

C10H8O2S2 — CID 15488041

IUPAC5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine
SMILESc1csc(-c2scc3c2OCCO3)c1
InChIInChI=1S/C10H8O2S2/c1-2-8(13-5-1)10-9-7(6-14-10)11-3-4-12-9/h1-2,5-6H,3-4H2
InChIKeyNYZAOHBPTKJUBI-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.25
Rot. Bonds1

About 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine

5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine (PubChem CID 15488041) has the molecular formula C10H8O2S2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine.

Molecular Properties

Compound Name5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine
PubChem CID15488041
Molecular FormulaC10H8O2S2
Molecular Weight224.31 g/mol
Exact Mass224.00
IUPAC Name5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine
SMILESc1csc(-c2scc3c2OCCO3)c1
InChIInChI=1S/C10H8O2S2/c1-2-8(13-5-1)10-9-7(6-14-10)11-3-4-12-9/h1-2,5-6H,3-4H2
InChIKeyNYZAOHBPTKJUBI-UHFFFAOYSA-N
XLogP3.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4'-Dimethoxy-2,2'-bithiophene
CID 642346
3,3'-Dibutoxy-2,2'-bithiophene
CID 11141443
7-Thiophen-2-yl-5-(7-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 15417852
2,2',3,3'-Tetrahydro-5,5'-bithieno[3,4-b][1,4]dioxine
CID 3761770
3-[2-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)thiophen-3-yl]sulfanylpropanenitrile
CID 5246968
Thieno[3,4-b]-1,4-dioxin, 5-hexyl-2,3-dihydro-
CID 11020600
2,2'-Bithiophene, 4,4'-bis(pentyloxy)-
CID 12097913
Bis(methoxy)-2,2'-bithiophene
CID 21615708
3,4-Dimethoxy-2,5-dithiophen-2-ylthiophene
CID 21692360
5,5'-(1,4-Phenylene)bis(2,3-dihydrothieno[3,4-b][1,4]dioxine)
CID 23103049
5-(4-Methoxyphenyl)-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 56924418
5,5'-(2,5-Thiophenediyl)bis[2,3-dihydrothieno[3,4-b]-1,4-dioxin]
CID 57370586

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The IUPAC name of 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine (CID 15488041) is 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine.
What is the SMILES notation for 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The canonical SMILES for 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine is c1csc(-c2scc3c2OCCO3)c1.
What is the InChIKey of 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The InChIKey is NYZAOHBPTKJUBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2S2/c1-2-8(13-5-1)10-9-7(6-14-10)11-3-4-12-9/h1-2,5-6H,3-4H2.
What are the key properties of 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine has a molecular weight of 224.31 g/mol, XLogP of 3.25, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-2,3-dihydrothieno[3,4-b][1,4]dioxine is sourced from PubChem (CID 15488041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).