3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol

C10H6OS4 — CID 101352467

IUPAC3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol
SMILESOC12c3sccc3SC1Sc1ccsc12
InChIInChI=1S/C10H6OS4/c11-10-7-5(1-3-12-7)14-9(10)15-6-2-4-13-8(6)10/h1-4,9,11H
InChIKeyYPPPTCHWPYTIJF-UHFFFAOYSA-N
MW270.43 g/mol
LogP3.58
Rot. Bonds

About 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol

3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol (PubChem CID 101352467) has the molecular formula C10H6OS4 and a molecular weight of 270.43 g/mol. Its IUPAC name is 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol.

Molecular Properties

Compound Name3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol
PubChem CID101352467
Molecular FormulaC10H6OS4
Molecular Weight270.43 g/mol
Exact Mass269.93
IUPAC Name3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol
SMILESOC12c3sccc3SC1Sc1ccsc12
InChIInChI=1S/C10H6OS4/c11-10-7-5(1-3-12-7)14-9(10)15-6-2-4-13-8(6)10/h1-4,9,11H
InChIKeyYPPPTCHWPYTIJF-UHFFFAOYSA-N
XLogP3.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.43
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol 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 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol?
The IUPAC name of 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol (CID 101352467) is 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol.
What is the SMILES notation for 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol?
The canonical SMILES for 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol is OC12c3sccc3SC1Sc1ccsc12.
What is the InChIKey of 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol?
The InChIKey is YPPPTCHWPYTIJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6OS4/c11-10-7-5(1-3-12-7)14-9(10)15-6-2-4-13-8(6)10/h1-4,9,11H.
What are the key properties of 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol?
3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol has a molecular weight of 270.43 g/mol, XLogP of 3.58, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7,9,13-tetrathiatetracyclo[6.6.0.02,6.010,14]tetradeca-2(6),4,10(14),11-tetraen-1-ol is sourced from PubChem (CID 101352467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).