WAY-636982 - 10mM in DMSO , CAS No.834-45-7

CAS: 834-45-7 Cat. No.: W426160 Summenformel: C₁₀H₁₄N₂O₄ Molekulargewicht: 226.23 EG-Nummer: 873-990-2 PubChem CID: 3162834

GRADE & PURITY 10mM in DMSO

Synonyms

SR-01000325110 | MFCD06363482 | FT-0677764 | A864263 | BB 0218609 | (2,4-Dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid | (2,4-DIOXO-1,3-DIAZASPIRO[4.5]DEC-3-YL)ACETICACID | EN300-10959 | BS-4335 | (2,4-Dioxo-1,3-diaza-spiro[4.5]dec-3-yl)-acetic acid | (

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

Aurora kinase A inhibitor

Specifications

Synonyme

SR-01000325110 | MFCD06363482 | FT-0677764 | A864263 | BB 0218609 | (2,4-Dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid | (2,4-DIOXO-1,3-DIAZASPIRO[4.5]DEC-3-YL)ACETICACID | EN300-10959 | BS-4335 | (2,4-Dioxo-1,3-diaza-spiro[4.5]dec-3-yl)-acetic acid | (

Spezifikationen & Reinheit

10mM in DMSO

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

Kanonisches Lächeln

C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)O

IUPAC Name

2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid

InChIKey

CGXTWPOZGXKGOX-UHFFFAOYSA-N

INCHI

1S/C10H14N2O4/c13-7(14)6-12-8(15)10(11-9(12)16)4-2-1-3-5-10/h1-6H2,(H,11,16)(H,13,14)

Isomere SMILES

C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)O

PubChem CID

3162834

Molekulargewicht

226.23

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Peptides
          • Ebene6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: Hydantoins Alpha amino acids and derivatives N-acyl ureas Dicarboximides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Alpha-dipeptide - Hydantoin - Alpha-amino acid or derivatives - N-acyl urea - Ureide - Imidazolidinone - Dicarboximide - Imidazolidine - Carbonic acid derivative - Urea - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 226.230 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 226.095 Da
• Monoisotopic Mass: 226.095 Da
• Topological Polar Surface Area: 86.700 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 347.000
• 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