2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan

C10H10O2S4 — CID 24832089

IUPAC2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan
SMILESCc1occc1SSSSc1ccoc1C
InChIInChI=1S/C10H10O2S4/c1-7-9(3-5-11-7)13-15-16-14-10-4-6-12-8(10)2/h3-6H,1-2H3
InChIKeyWCQMHJWTXQMUQE-UHFFFAOYSA-N
MW290.46 g/mol
LogP5.59
Rot. Bonds5

About 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan

2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan (PubChem CID 24832089) has the molecular formula C10H10O2S4 and a molecular weight of 290.46 g/mol. Its IUPAC name is 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan.

Molecular Properties

Compound Name2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan
PubChem CID24832089
Molecular FormulaC10H10O2S4
Molecular Weight290.46 g/mol
Exact Mass289.96
IUPAC Name2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan
SMILESCc1occc1SSSSc1ccoc1C
InChIInChI=1S/C10H10O2S4/c1-7-9(3-5-11-7)13-15-16-14-10-4-6-12-8(10)2/h3-6H,1-2H3
InChIKeyWCQMHJWTXQMUQE-UHFFFAOYSA-N
XLogP5.59
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.46
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}

Analyze 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan 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 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan?
The IUPAC name of 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan (CID 24832089) is 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan.
What is the SMILES notation for 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan?
The canonical SMILES for 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan is Cc1occc1SSSSc1ccoc1C.
What is the InChIKey of 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan?
The InChIKey is WCQMHJWTXQMUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2S4/c1-7-9(3-5-11-7)13-15-16-14-10-4-6-12-8(10)2/h3-6H,1-2H3.
What are the key properties of 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan?
2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan has a molecular weight of 290.46 g/mol, XLogP of 5.59, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan is sourced from PubChem (CID 24832089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).