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

CAS: 1821370-71-1 Cat. No.: P412967 분자식: C₁₀H₆N₂O₄S 분자량: 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

개요

Information

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

Specifications

동의어

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

사양 및 순도

Moligand™,≥98%

생화학 및 생리적 메커니즘

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

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

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등급

Moligand™

작업 유형

INHIBITOR

순수함

≥98%

이름과 식별자

• 정식 스마일: 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)
• 이성체 SMILES: C1=CC(=NC=C1C(=O)O)C2=NC=C(S2)C(=O)O
• PubChem CID: 122554526
• 분자량: 250.23

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: 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
• 설명: 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

화학 및 물리적 특성

• 분자량: 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