PythiDC - Moligand™,≥98% , CAS No.1821370-71-1

CAS: 1821370-71-1 Cat. No.: P412967 Molecular Weight: 250.23 PubChem CID: 122554526

GRADE & PURITY Moligand™, ≥98%

Synonyms

2-(5-carboxypyridin-2-yl)-1,3-thiazole-5-carboxylic acid | DTXSID101222244 | 2-(5-carboxythiazol-2-yl)pyridine-5-carboxylic acid | 6-(5-carboxy-1,3-thiazol-2-yl)pyridine-3-carboxylic acid | SCHEMBL18093546 | EX-A4845 | 3-Pyridinecarboxylic acid, 6-(5-carb

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Information

PythiDC is a selective inhibitor of collagen prolyl 4-hydroxylase.

Specifications

Synonyms

2-(5-carboxypyridin-2-yl)-1, 3-thiazole-5-carboxylic acid | DTXSID101222244 | 2-(5-carboxythiazol-2-yl)pyridine-5-carboxylic acid | 6-(5-carboxy-1, 3-thiazol-2-yl)pyridine-3-carboxylic acid | SCHEMBL18093546 | EX-A4845 | 3-Pyridinecarboxylic acid, 6-(5-carb

Specifications & Purity

Moligand™, ≥98%

Biochemical and Physiological Mechanisms

PythiDC is a selective inhibitor of collagen prolyl 4-hydroxylase.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

INHIBITOR

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1=CC(=NC=C1C(=O)O)C2=NC=C(S2)C(=O)O
• IUPAC Name: 2-(5-carboxypyridin-2-yl)-1,3-thiazole-5-carboxylic acid
• InChIKey: ISYUGJYTQIZJHV-UHFFFAOYSA-N
• INCHI: 1S/C10H6N2O4S/c13-9(14)5-1-2-6(11-3-5)8-12-4-7(17-8)10(15)16/h1-4H,(H,13,14)(H,15,16)
• Isomeric SMILES: C1=CC(=NC=C1C(=O)O)C2=NC=C(S2)C(=O)O
• PubChem CID: 122554526
• Molecular Weight: 250.23

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxylic acids
• Alternative Parents: Thiazolecarboxylic acids and derivatives Hydroxypyridines Heterocyclic fatty acids Branched fatty acids Unsaturated fatty acids Dicarboxylic acids and derivatives Secondary ketimines Heteroaromatic compounds Imidothioesters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Imidothioic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine carboxylic acid - Thiazolecarboxylic acid or derivatives - Hydroxypyridine - Heterocyclic fatty acid - Branched fatty acid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Thiazole - Secondary ketimine - Azole - Ketimine - Imidothioester - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Imidothioic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Imine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Molecular Weight: 250.230 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 250.005 Da
• Monoisotopic Mass: 250.005 Da
• Topological Polar Surface Area: 129.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 325.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1