2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

C15H14N2OS — CID 142131081

IUPAC2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCC1=C(c2cc(C)cc3occc23)N2CCN=C2S1
InChIInChI=1S/C15H14N2OS/c1-9-7-12(11-3-6-18-13(11)8-9)14-10(2)19-15-16-4-5-17(14)15/h3,6-8H,4-5H2,1-2H3
InChIKeyLKSANQBPABAJCH-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.85
Rot. Bonds1

About 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (PubChem CID 142131081) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
PubChem CID142131081
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCC1=C(c2cc(C)cc3occc23)N2CCN=C2S1
InChIInChI=1S/C15H14N2OS/c1-9-7-12(11-3-6-18-13(11)8-9)14-10(2)19-15-16-4-5-17(14)15/h3,6-8H,4-5H2,1-2H3
InChIKeyLKSANQBPABAJCH-UHFFFAOYSA-N
XLogP3.85
TPSA28.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (CID 142131081) is 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is CC1=C(c2cc(C)cc3occc23)N2CCN=C2S1.
What is the InChIKey of 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is LKSANQBPABAJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-9-7-12(11-3-6-18-13(11)8-9)14-10(2)19-15-16-4-5-17(14)15/h3,6-8H,4-5H2,1-2H3.
What are the key properties of 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 270.36 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(6-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 142131081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).