3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene

C12H14S3 — CID 19937208

IUPAC3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene
SMILESC1=CSC(C2=CC(C3CC=CS3)CS2)C1
InChIInChI=1S/C12H14S3/c1-3-10(13-5-1)9-7-12(15-8-9)11-4-2-6-14-11/h1-2,5-7,9-11H,3-4,8H2
InChIKeyHWQKQRDABBBZGT-UHFFFAOYSA-N
MW254.44 g/mol
LogP4.27
Rot. Bonds2

About 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene

3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene (PubChem CID 19937208) has the molecular formula C12H14S3 and a molecular weight of 254.44 g/mol. Its IUPAC name is 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene.

Molecular Properties

Compound Name3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene
PubChem CID19937208
Molecular FormulaC12H14S3
Molecular Weight254.44 g/mol
Exact Mass254.03
IUPAC Name3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene
SMILESC1=CSC(C2=CC(C3CC=CS3)CS2)C1
InChIInChI=1S/C12H14S3/c1-3-10(13-5-1)9-7-12(15-8-9)11-4-2-6-14-11/h1-2,5-7,9-11H,3-4,8H2
InChIKeyHWQKQRDABBBZGT-UHFFFAOYSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.44
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene?
The IUPAC name of 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene (CID 19937208) is 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene.
What is the SMILES notation for 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene?
The canonical SMILES for 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene is C1=CSC(C2=CC(C3CC=CS3)CS2)C1.
What is the InChIKey of 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene?
The InChIKey is HWQKQRDABBBZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14S3/c1-3-10(13-5-1)9-7-12(15-8-9)11-4-2-6-14-11/h1-2,5-7,9-11H,3-4,8H2.
What are the key properties of 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene?
3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene has a molecular weight of 254.44 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(2,3-dihydrothiophen-2-yl)-2,3-dihydrothiophene is sourced from PubChem (CID 19937208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).