2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene

C10H8N2O2S5 — CID 174841150

IUPAC2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene
SMILESc1ccsc1.c1coc(SSSSc2ncco2)n1
InChIInChI=1S/C6H4N2O2S4.C4H4S/c1-3-9-5(7-1)11-13-14-12-6-8-2-4-10-6;1-2-4-5-3-1/h1-4H;1-4H
InChIKeyDTXYHYPRWMYWSV-UHFFFAOYSA-N
MW348.52 g/mol
LogP5.51
Rot. Bonds5

About 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene

2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene (PubChem CID 174841150) has the molecular formula C10H8N2O2S5 and a molecular weight of 348.52 g/mol. Its IUPAC name is 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene.

Molecular Properties

Compound Name2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene
PubChem CID174841150
Molecular FormulaC10H8N2O2S5
Molecular Weight348.52 g/mol
Exact Mass347.92
IUPAC Name2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene
SMILESc1ccsc1.c1coc(SSSSc2ncco2)n1
InChIInChI=1S/C6H4N2O2S4.C4H4S/c1-3-9-5(7-1)11-13-14-12-6-8-2-4-10-6;1-2-4-5-3-1/h1-4H;1-4H
InChIKeyDTXYHYPRWMYWSV-UHFFFAOYSA-N
XLogP5.51
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.52
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene?
The IUPAC name of 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene (CID 174841150) is 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene.
What is the SMILES notation for 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene?
The canonical SMILES for 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene is c1ccsc1.c1coc(SSSSc2ncco2)n1.
What is the InChIKey of 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene?
The InChIKey is DTXYHYPRWMYWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2O2S4.C4H4S/c1-3-9-5(7-1)11-13-14-12-6-8-2-4-10-6;1-2-4-5-3-1/h1-4H;1-4H.
What are the key properties of 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene?
2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene has a molecular weight of 348.52 g/mol, XLogP of 5.51, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-oxazol-2-yltetrasulfanyl)-1,3-oxazole;thiophene is sourced from PubChem (CID 174841150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).