2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

C15H14N2S4 — CID 22474256

IUPAC2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCSC1=C(c2ccc(SC)c3sccc23)N2CCN=C2S1
InChIInChI=1S/C15H14N2S4/c1-18-11-4-3-9(10-5-8-20-13(10)11)12-14(19-2)21-15-16-6-7-17(12)15/h3-5,8H,6-7H2,1-2H3
InChIKeyBZTABQNSBWPNBH-UHFFFAOYSA-N
MW350.56 g/mol
LogP5.03
Rot. Bonds3

About 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (PubChem CID 22474256) has the molecular formula C15H14N2S4 and a molecular weight of 350.56 g/mol. Its IUPAC name is 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
PubChem CID22474256
Molecular FormulaC15H14N2S4
Molecular Weight350.56 g/mol
Exact Mass350.00
IUPAC Name2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCSC1=C(c2ccc(SC)c3sccc23)N2CCN=C2S1
InChIInChI=1S/C15H14N2S4/c1-18-11-4-3-9(10-5-8-20-13(10)11)12-14(19-2)21-15-16-6-7-17(12)15/h3-5,8H,6-7H2,1-2H3
InChIKeyBZTABQNSBWPNBH-UHFFFAOYSA-N
XLogP5.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.56
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole 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 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (CID 22474256) is 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is CSC1=C(c2ccc(SC)c3sccc23)N2CCN=C2S1.
What is the InChIKey of 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is BZTABQNSBWPNBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S4/c1-18-11-4-3-9(10-5-8-20-13(10)11)12-14(19-2)21-15-16-6-7-17(12)15/h3-5,8H,6-7H2,1-2H3.
What are the key properties of 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 350.56 g/mol, XLogP of 5.03, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfanyl-3-(7-methylsulfanyl-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 22474256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).