1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol

C8H8F2N2OS — CID 112575612

IUPAC1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
SMILESOC(Cc1cn2ccsc2n1)C(F)F
InChIInChI=1S/C8H8F2N2OS/c9-7(10)6(13)3-5-4-12-1-2-14-8(12)11-5/h1-2,4,6-7,13H,3H2
InChIKeyZAGMQJFWEIRRKR-UHFFFAOYSA-N
MW218.23 g/mol
LogP1.56
Rot. Bonds3

About 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol

1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol (PubChem CID 112575612) has the molecular formula C8H8F2N2OS and a molecular weight of 218.23 g/mol. Its IUPAC name is 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol.

Molecular Properties

Compound Name1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
PubChem CID112575612
Molecular FormulaC8H8F2N2OS
Molecular Weight218.23 g/mol
Exact Mass218.03
IUPAC Name1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
SMILESOC(Cc1cn2ccsc2n1)C(F)F
InChIInChI=1S/C8H8F2N2OS/c9-7(10)6(13)3-5-4-12-1-2-14-8(12)11-5/h1-2,4,6-7,13H,3H2
InChIKeyZAGMQJFWEIRRKR-UHFFFAOYSA-N
XLogP1.56
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol?
The IUPAC name of 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol (CID 112575612) is 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol.
What is the SMILES notation for 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol?
The canonical SMILES for 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol is OC(Cc1cn2ccsc2n1)C(F)F.
What is the InChIKey of 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol?
The InChIKey is ZAGMQJFWEIRRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2OS/c9-7(10)6(13)3-5-4-12-1-2-14-8(12)11-5/h1-2,4,6-7,13H,3H2.
What are the key properties of 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol?
1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol has a molecular weight of 218.23 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol is sourced from PubChem (CID 112575612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).