N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide

C12H10F3N3O3S2 — CID 3235976

IUPACN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide
SMILESO=C1N2CCSC2=NC1(NS(=O)(=O)c1ccccc1)C(F)(F)F
InChIInChI=1S/C12H10F3N3O3S2/c13-12(14,15)11(9(19)18-6-7-22-10(18)16-11)17-23(20,21)8-4-2-1-3-5-8/h1-5,17H,6-7H2
InChIKeyIPQOMOGAHHLPGC-UHFFFAOYSA-N
MW365.36 g/mol
LogP1.17
Rot. Bonds3

About N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide

N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide (PubChem CID 3235976) has the molecular formula C12H10F3N3O3S2 and a molecular weight of 365.36 g/mol. Its IUPAC name is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide
PubChem CID3235976
Molecular FormulaC12H10F3N3O3S2
Molecular Weight365.36 g/mol
Exact Mass365.01
IUPAC NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide
SMILESO=C1N2CCSC2=NC1(NS(=O)(=O)c1ccccc1)C(F)(F)F
InChIInChI=1S/C12H10F3N3O3S2/c13-12(14,15)11(9(19)18-6-7-22-10(18)16-11)17-23(20,21)8-4-2-1-3-5-8/h1-5,17H,6-7H2
InChIKeyIPQOMOGAHHLPGC-UHFFFAOYSA-N
XLogP1.17
TPSA78.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.36
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide?
The IUPAC name of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide (CID 3235976) is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide.
What is the SMILES notation for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide?
The canonical SMILES for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide is O=C1N2CCSC2=NC1(NS(=O)(=O)c1ccccc1)C(F)(F)F.
What is the InChIKey of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide?
The InChIKey is IPQOMOGAHHLPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F3N3O3S2/c13-12(14,15)11(9(19)18-6-7-22-10(18)16-11)17-23(20,21)8-4-2-1-3-5-8/h1-5,17H,6-7H2.
What are the key properties of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide?
N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide has a molecular weight of 365.36 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]benzenesulfonamide is sourced from PubChem (CID 3235976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).