(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one

C13H12N2O2S — CID 10730056

IUPAC(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
SMILESCOc1ccccc1/C=C1/N=C2SCCN2C1=O
InChIInChI=1S/C13H12N2O2S/c1-17-11-5-3-2-4-9(11)8-10-12(16)15-6-7-18-13(15)14-10/h2-5,8H,6-7H2,1H3/b10-8+
InChIKeyXLCOPLUNPIHUOW-CSKARUKUSA-N
MW260.32 g/mol
LogP1.98
Rot. Bonds2

About (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one

(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one (PubChem CID 10730056) has the molecular formula C13H12N2O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one.

Molecular Properties

Compound Name(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
PubChem CID10730056
Molecular FormulaC13H12N2O2S
Molecular Weight260.32 g/mol
Exact Mass260.06
IUPAC Name(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
SMILESCOc1ccccc1/C=C1/N=C2SCCN2C1=O
InChIInChI=1S/C13H12N2O2S/c1-17-11-5-3-2-4-9(11)8-10-12(16)15-6-7-18-13(15)14-10/h2-5,8H,6-7H2,1H3/b10-8+
InChIKeyXLCOPLUNPIHUOW-CSKARUKUSA-N
XLogP1.98
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(5E)-5-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-one
CID 10753827
(6E)-6-[(4-chlorophenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
CID 6449139
6-(2-methoxyphenyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-5,7-dione
CID 13131698
(7Z)-7-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-2,4-dihydroimidazo[2,1-b][1,3,5]thiadiazin-6-one
CID 42534534
4-[(4E)-4-[(2-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]benzoic acid
CID 6447765
2-(azepan-1-yl)-5-[(2-methoxyphenyl)methylidene]-1,3-thiazol-4-one
CID 2878171
2-[4-[(2-methoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]acetic acid
CID 5072268
(4E)-2-cyclopentyl-4-[(2-methoxyphenyl)methylidene]-1H-imidazol-5-one
CID 136893767
(4Z)-4-[(2-methoxyphenyl)methylidene]-2-(4-methylphenyl)-1,3-thiazol-5-one
CID 6537013
(5E)-3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-[(2-methoxyphenyl)methylidene]-2-phenylimidazol-4-one
CID 1273988
[2-[(E)-(3-oxo-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-2-ylidene)methyl]phenyl] acetate
CID 1493029
(3E,5E)-3,5-bis[(2-methoxyphenyl)methylidene]oxan-4-one
CID 121461091

Frequently Asked Questions

What is the IUPAC name of (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The IUPAC name of (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one (CID 10730056) is (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one.
What is the SMILES notation for (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The canonical SMILES for (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one is COc1ccccc1/C=C1/N=C2SCCN2C1=O.
What is the InChIKey of (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
The InChIKey is XLCOPLUNPIHUOW-CSKARUKUSA-N. The full InChI is InChI=1S/C13H12N2O2S/c1-17-11-5-3-2-4-9(11)8-10-12(16)15-6-7-18-13(15)14-10/h2-5,8H,6-7H2,1H3/b10-8+.
What are the key properties of (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one?
(6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one has a molecular weight of 260.32 g/mol, XLogP of 1.98, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-6-[(2-methoxyphenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one is sourced from PubChem (CID 10730056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).