7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole

C7H7FN2S2 — CID 22631659

IUPAC7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole
SMILESFCCSc1ncn2ccsc12
InChIInChI=1S/C7H7FN2S2/c8-1-3-11-6-7-10(5-9-6)2-4-12-7/h2,4-5H,1,3H2
InChIKeyJTIDXIBUPXKJAY-UHFFFAOYSA-N
MW202.28 g/mol
LogP2.46
Rot. Bonds3

About 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole

7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole (PubChem CID 22631659) has the molecular formula C7H7FN2S2 and a molecular weight of 202.28 g/mol. Its IUPAC name is 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole.

Molecular Properties

Compound Name7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole
PubChem CID22631659
Molecular FormulaC7H7FN2S2
Molecular Weight202.28 g/mol
Exact Mass202.00
IUPAC Name7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole
SMILESFCCSc1ncn2ccsc12
InChIInChI=1S/C7H7FN2S2/c8-1-3-11-6-7-10(5-9-6)2-4-12-7/h2,4-5H,1,3H2
InChIKeyJTIDXIBUPXKJAY-UHFFFAOYSA-N
XLogP2.46
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole?
The IUPAC name of 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole (CID 22631659) is 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole.
What is the SMILES notation for 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole?
The canonical SMILES for 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole is FCCSc1ncn2ccsc12.
What is the InChIKey of 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole?
The InChIKey is JTIDXIBUPXKJAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2S2/c8-1-3-11-6-7-10(5-9-6)2-4-12-7/h2,4-5H,1,3H2.
What are the key properties of 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole?
7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole has a molecular weight of 202.28 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-fluoroethylsulfanyl)imidazo[5,1-b][1,3]thiazole is sourced from PubChem (CID 22631659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).