2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan

C14H14OS2 — CID 79326430

IUPAC2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan
SMILESc1coc(CSCC2Cc3ccccc3S2)c1
InChIInChI=1S/C14H14OS2/c1-2-6-14-11(4-1)8-13(17-14)10-16-9-12-5-3-7-15-12/h1-7,13H,8-10H2
InChIKeyTWCWCXGWHJVMAS-UHFFFAOYSA-N
MW262.40 g/mol
LogP4.23
Rot. Bonds4

About 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan

2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan (PubChem CID 79326430) has the molecular formula C14H14OS2 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan
PubChem CID79326430
Molecular FormulaC14H14OS2
Molecular Weight262.40 g/mol
Exact Mass262.05
IUPAC Name2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan
SMILESc1coc(CSCC2Cc3ccccc3S2)c1
InChIInChI=1S/C14H14OS2/c1-2-6-14-11(4-1)8-13(17-14)10-16-9-12-5-3-7-15-12/h1-7,13H,8-10H2
InChIKeyTWCWCXGWHJVMAS-UHFFFAOYSA-N
XLogP4.23
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan 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

2-(2-methylpropylsulfanylmethyl)-2,3-dihydro-1-benzothiophene
CID 79326208
2-(2,3-dihydro-1-benzothiophen-3-ylmethylsulfanylmethyl)furan
CID 79326319
2-(cyclopropylmethylsulfanylmethyl)furan
CID 131208712
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine
CID 105177243
2-amino-3-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)propanoic acid
CID 79223038
2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)pyrimidine
CID 79326097
3-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)-2-methylpropanoic acid
CID 79212466
2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)-4-methyl-1,3-oxazole
CID 106924341
N-(furan-2-ylmethyl)-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 18134735
methyl 3-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)-2-methylpropanoate
CID 79213130
3-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanyl)-4-methyl-1,2,4-triazole
CID 79325980
2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)-2,3-dihydro-1-benzothiophene
CID 79322659

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan?
The IUPAC name of 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan (CID 79326430) is 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan.
What is the SMILES notation for 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan?
The canonical SMILES for 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan is c1coc(CSCC2Cc3ccccc3S2)c1.
What is the InChIKey of 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan?
The InChIKey is TWCWCXGWHJVMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14OS2/c1-2-6-14-11(4-1)8-13(17-14)10-16-9-12-5-3-7-15-12/h1-7,13H,8-10H2.
What are the key properties of 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan?
2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan has a molecular weight of 262.40 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan is sourced from PubChem (CID 79326430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).