[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol

C15H14N2OS2 — CID 22474216

IUPAC[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol
SMILESCc1cc2c(C3=C(CO)SC4=NCCN43)cccc2s1
InChIInChI=1S/C15H14N2OS2/c1-9-7-11-10(3-2-4-12(11)19-9)14-13(8-18)20-15-16-5-6-17(14)15/h2-4,7,18H,5-6,8H2,1H3
InChIKeyOPPJVQWZSTUWRK-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.29
Rot. Bonds2

About [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol

[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol (PubChem CID 22474216) has the molecular formula C15H14N2OS2 and a molecular weight of 302.42 g/mol. Its IUPAC name is [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol.

Molecular Properties

Compound Name[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol
PubChem CID22474216
Molecular FormulaC15H14N2OS2
Molecular Weight302.42 g/mol
Exact Mass302.05
IUPAC Name[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol
SMILESCc1cc2c(C3=C(CO)SC4=NCCN43)cccc2s1
InChIInChI=1S/C15H14N2OS2/c1-9-7-11-10(3-2-4-12(11)19-9)14-13(8-18)20-15-16-5-6-17(14)15/h2-4,7,18H,5-6,8H2,1H3
InChIKeyOPPJVQWZSTUWRK-UHFFFAOYSA-N
XLogP3.29
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol 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 [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol?
The IUPAC name of [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol (CID 22474216) is [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol.
What is the SMILES notation for [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol?
The canonical SMILES for [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol is Cc1cc2c(C3=C(CO)SC4=NCCN43)cccc2s1.
What is the InChIKey of [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol?
The InChIKey is OPPJVQWZSTUWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS2/c1-9-7-11-10(3-2-4-12(11)19-9)14-13(8-18)20-15-16-5-6-17(14)15/h2-4,7,18H,5-6,8H2,1H3.
What are the key properties of [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol?
[3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol has a molecular weight of 302.42 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol is sourced from PubChem (CID 22474216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).