2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide

C14H14N4OS2 — CID 2999952

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
SMILESO=C(Cc1cn2ccsc2n1)Nc1nc2c(s1)CCCC2
InChIInChI=1S/C14H14N4OS2/c19-12(7-9-8-18-5-6-20-14(18)15-9)17-13-16-10-3-1-2-4-11(10)21-13/h5-6,8H,1-4,7H2,(H,16,17,19)
InChIKeyQELSJLQKTGXHEJ-UHFFFAOYSA-N
MW318.43 g/mol
LogP2.91
Rot. Bonds3

About 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide (PubChem CID 2999952) has the molecular formula C14H14N4OS2 and a molecular weight of 318.43 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
PubChem CID2999952
Molecular FormulaC14H14N4OS2
Molecular Weight318.43 g/mol
Exact Mass318.06
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
SMILESO=C(Cc1cn2ccsc2n1)Nc1nc2c(s1)CCCC2
InChIInChI=1S/C14H14N4OS2/c19-12(7-9-8-18-5-6-20-14(18)15-9)17-13-16-10-3-1-2-4-11(10)21-13/h5-6,8H,1-4,7H2,(H,16,17,19)
InChIKeyQELSJLQKTGXHEJ-UHFFFAOYSA-N
XLogP2.91
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.43
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 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-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide (CID 2999952) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide is O=C(Cc1cn2ccsc2n1)Nc1nc2c(s1)CCCC2.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide?
The InChIKey is QELSJLQKTGXHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS2/c19-12(7-9-8-18-5-6-20-14(18)15-9)17-13-16-10-3-1-2-4-11(10)21-13/h5-6,8H,1-4,7H2,(H,16,17,19).
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide?
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide has a molecular weight of 318.43 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide is sourced from PubChem (CID 2999952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).