(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one

C9H7F3N4OS2 — CID 2057161

IUPAC(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
SMILESO=C1N2CCSC2=N[C@]1(Nc1nccs1)C(F)(F)F
InChIInChI=1S/C9H7F3N4OS2/c10-9(11,12)8(14-6-13-1-3-18-6)5(17)16-2-4-19-7(16)15-8/h1,3H,2,4H2,(H,13,14)/t8-/m0/s1
InChIKeyHQVDQPUQHSZDGV-QMMMGPOBSA-N
MW308.31 g/mol
LogP1.76
Rot. Bonds2

About (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one

(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one (PubChem CID 2057161) has the molecular formula C9H7F3N4OS2 and a molecular weight of 308.31 g/mol. Its IUPAC name is (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one.

Molecular Properties

Compound Name(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
PubChem CID2057161
Molecular FormulaC9H7F3N4OS2
Molecular Weight308.31 g/mol
Exact Mass308.00
IUPAC Name(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
SMILESO=C1N2CCSC2=N[C@]1(Nc1nccs1)C(F)(F)F
InChIInChI=1S/C9H7F3N4OS2/c10-9(11,12)8(14-6-13-1-3-18-6)5(17)16-2-4-19-7(16)15-8/h1,3H,2,4H2,(H,13,14)/t8-/m0/s1
InChIKeyHQVDQPUQHSZDGV-QMMMGPOBSA-N
XLogP1.76
TPSA57.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.31
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one 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 (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The IUPAC name of (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one (CID 2057161) is (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one.
What is the SMILES notation for (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The canonical SMILES for (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one is O=C1N2CCSC2=N[C@]1(Nc1nccs1)C(F)(F)F.
What is the InChIKey of (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The InChIKey is HQVDQPUQHSZDGV-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H7F3N4OS2/c10-9(11,12)8(14-6-13-1-3-18-6)5(17)16-2-4-19-7(16)15-8/h1,3H,2,4H2,(H,13,14)/t8-/m0/s1.
What are the key properties of (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
(6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one has a molecular weight of 308.31 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-(1,3-thiazol-2-ylamino)-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one is sourced from PubChem (CID 2057161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).