3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole

C17H18N2OS — CID 142131134

IUPAC3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCc1cc(C2=C(C(C)C)SC3=NCCN32)cc2ccoc12
InChIInChI=1S/C17H18N2OS/c1-10(2)16-14(19-6-5-18-17(19)21-16)13-8-11(3)15-12(9-13)4-7-20-15/h4,7-10H,5-6H2,1-3H3
InChIKeyDZNXMONFFURXLZ-UHFFFAOYSA-N
MW298.41 g/mol
LogP4.48
Rot. Bonds2

About 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole

3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole (PubChem CID 142131134) has the molecular formula C17H18N2OS and a molecular weight of 298.41 g/mol. Its IUPAC name is 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
PubChem CID142131134
Molecular FormulaC17H18N2OS
Molecular Weight298.41 g/mol
Exact Mass298.11
IUPAC Name3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCc1cc(C2=C(C(C)C)SC3=NCCN32)cc2ccoc12
InChIInChI=1S/C17H18N2OS/c1-10(2)16-14(19-6-5-18-17(19)21-16)13-8-11(3)15-12(9-13)4-7-20-15/h4,7-10H,5-6H2,1-3H3
InChIKeyDZNXMONFFURXLZ-UHFFFAOYSA-N
XLogP4.48
TPSA28.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-3-(7-methyl-1-benzofuran-5-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142131196
1-[3-(4-methyl-1-benzofuran-6-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 142131047
2-methyl-3-(5-methyl-1-benzofuran-7-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142131102
1-[3-(1-benzofuran-6-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 142130972
3-(5-fluoro-1-benzofuran-7-yl)-2-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130952
1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 142131133
2-methyl-3-(2-methyl-1-benzofuran-7-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130991
2-ethyl-3-(7-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130957
3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 22473909
7-methyl-5-(4-methylphenyl)-1-benzofuran
CID 142970996
3-(4-methyl-1-benzofuran-7-yl)-2-propyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130930
1-[3-(1-benzothiophen-2-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22473746

Frequently Asked Questions

What is the IUPAC name of 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole (CID 142131134) is 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole is Cc1cc(C2=C(C(C)C)SC3=NCCN32)cc2ccoc12.
What is the InChIKey of 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is DZNXMONFFURXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2OS/c1-10(2)16-14(19-6-5-18-17(19)21-16)13-8-11(3)15-12(9-13)4-7-20-15/h4,7-10H,5-6H2,1-3H3.
What are the key properties of 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 298.41 g/mol, XLogP of 4.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methyl-1-benzofuran-5-yl)-2-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 142131134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).