6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C10H7N5O3S — CID 64780586

IUPAC6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESNC(=O)c1ccn(-c2nc3sccn3c2C(=O)O)n1
InChIInChI=1S/C10H7N5O3S/c11-7(16)5-1-2-15(13-5)8-6(9(17)18)14-3-4-19-10(14)12-8/h1-4H,(H2,11,16)(H,17,18)
InChIKeyYUHLZNFNFPKWBF-UHFFFAOYSA-N
MW277.27 g/mol
LogP0.38
Rot. Bonds3

About 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 64780586) has the molecular formula C10H7N5O3S and a molecular weight of 277.27 g/mol. Its IUPAC name is 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID64780586
Molecular FormulaC10H7N5O3S
Molecular Weight277.27 g/mol
Exact Mass277.03
IUPAC Name6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESNC(=O)c1ccn(-c2nc3sccn3c2C(=O)O)n1
InChIInChI=1S/C10H7N5O3S/c11-7(16)5-1-2-15(13-5)8-6(9(17)18)14-3-4-19-10(14)12-8/h1-4H,(H2,11,16)(H,17,18)
InChIKeyYUHLZNFNFPKWBF-UHFFFAOYSA-N
XLogP0.38
TPSA115.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid 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 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 64780586) is 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid is NC(=O)c1ccn(-c2nc3sccn3c2C(=O)O)n1.
What is the InChIKey of 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is YUHLZNFNFPKWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5O3S/c11-7(16)5-1-2-15(13-5)8-6(9(17)18)14-3-4-19-10(14)12-8/h1-4H,(H2,11,16)(H,17,18).
What are the key properties of 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 277.27 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 64780586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).