CID 14925385

C18H16S4 — CID 14925385

IUPAC—
SMILESc1cc2c3c(ccc4c3c1CC41SCCS1)CC21SCCS1
InChIInChI=1S/C18H16S4/c1-3-13-16-12(10-18(13)21-7-8-22-18)2-4-14-15(16)11(1)9-17(14)19-5-6-20-17/h1-4H,5-10H2
InChIKeyUPMURWOEJBVAHZ-UHFFFAOYSA-N
MW360.59 g/mol
LogP5.22
Rot. Bonds

About CID 14925385

CID 14925385 (PubChem CID 14925385) has the molecular formula C18H16S4 and a molecular weight of 360.59 g/mol.

Molecular Properties

Compound NameCID 14925385
PubChem CID14925385
Molecular FormulaC18H16S4
Molecular Weight360.59 g/mol
Exact Mass360.01
IUPAC Name—
SMILESc1cc2c3c(ccc4c3c1CC41SCCS1)CC21SCCS1
InChIInChI=1S/C18H16S4/c1-3-13-16-12(10-18(13)21-7-8-22-18)2-4-14-15(16)11(1)9-17(14)19-5-6-20-17/h1-4H,5-10H2
InChIKeyUPMURWOEJBVAHZ-UHFFFAOYSA-N
XLogP5.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.59
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 14925385?
The IUPAC name of CID 14925385 (CID 14925385) is not available.
What is the SMILES notation for CID 14925385?
The canonical SMILES for CID 14925385 is c1cc2c3c(ccc4c3c1CC41SCCS1)CC21SCCS1.
What is the InChIKey of CID 14925385?
The InChIKey is UPMURWOEJBVAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16S4/c1-3-13-16-12(10-18(13)21-7-8-22-18)2-4-14-15(16)11(1)9-17(14)19-5-6-20-17/h1-4H,5-10H2.
What are the key properties of CID 14925385?
CID 14925385 has a molecular weight of 360.59 g/mol, XLogP of 5.22, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 14925385 is sourced from PubChem (CID 14925385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).