1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C24H18N6OS2 — CID 16593054

IUPAC1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCn1ncc2c(C(=O)Nc3ccc(-c4cn5ccsc5n4)cc3)cc(-c3cccs3)nc21
InChIInChI=1S/C24H18N6OS2/c1-2-30-22-18(13-25-30)17(12-19(27-22)21-4-3-10-32-21)23(31)26-16-7-5-15(6-8-16)20-14-29-9-11-33-24(29)28-20/h3-14H,2H2,1H3,(H,26,31)
InChIKeyKMKNHTUCKXVHMX-UHFFFAOYSA-N
MW470.58 g/mol
LogP5.81
Rot. Bonds5

About 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 16593054) has the molecular formula C24H18N6OS2 and a molecular weight of 470.58 g/mol. Its IUPAC name is 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID16593054
Molecular FormulaC24H18N6OS2
Molecular Weight470.58 g/mol
Exact Mass470.10
IUPAC Name1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCn1ncc2c(C(=O)Nc3ccc(-c4cn5ccsc5n4)cc3)cc(-c3cccs3)nc21
InChIInChI=1S/C24H18N6OS2/c1-2-30-22-18(13-25-30)17(12-19(27-22)21-4-3-10-32-21)23(31)26-16-7-5-15(6-8-16)20-14-29-9-11-33-24(29)28-20/h3-14H,2H2,1H3,(H,26,31)
InChIKeyKMKNHTUCKXVHMX-UHFFFAOYSA-N
XLogP5.81
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.58
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide 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 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 16593054) is 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CCn1ncc2c(C(=O)Nc3ccc(-c4cn5ccsc5n4)cc3)cc(-c3cccs3)nc21.
What is the InChIKey of 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is KMKNHTUCKXVHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N6OS2/c1-2-30-22-18(13-25-30)17(12-19(27-22)21-4-3-10-32-21)23(31)26-16-7-5-15(6-8-16)20-14-29-9-11-33-24(29)28-20/h3-14H,2H2,1H3,(H,26,31).
What are the key properties of 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 470.58 g/mol, XLogP of 5.81, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 16593054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).