탈리도마이드-d4 - ≥98 원자% D,≥98% , CAS No.1219177-18-0

CAS: 1219177-18-0 Cat. No.: T357985 분자식: C₁₃H₆D₄N₂O₄ 분자량: 262.25

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

(±)-2-(2,6-Dioxo-3-piperidinyl)-1H-Isoindole-1,3(2H)-dione | 2-Phthalimidoglutarimide

Storage

20°C에서 보관

Shipped In

아이스 박스 + 아이스 패드

개요

표지된 탈리도마이드는 FGF에 의한 혈관 신생을 억제합니다. 인간 면역 결핍 바이러스 1형의 복제를 억제합니다. 기형 유발 진정제.

Specifications

동의어

(±)-2-(2,6-Dioxo-3-piperidinyl)-1H-Isoindole-1,3(2H)-dione | 2-Phthalimidoglutarimide

사양 및 순도

≥98 원자% D,≥98%

보관 조건

20°C에서 보관

배송

아이스 박스 + 아이스 패드

순수함

≥98 atom% D,≥98%

이름과 식별자

• Pubchem Sid: 528772861
• 정식 스마일: C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O
• IUPAC Name: 4,5,6,7-tetradeuterio-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
• InChIKey: UEJJHQNACJXSKW-RHQRLBAQSA-N
• INCHI: 1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)/i1D,2D,3D,4D
• 이성체 SMILES: [2H]C1=C(C(=C2C(=C1[2H])C(=O)N(C2=O)C3CCC(=O)NC3=O)[2H])[2H]
• 대체 CAS: 50-35-1（unlabelled）
• 분자량: 262.25

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Isoindoles and derivatives
      • Subclass Isoindolines
        • Level5 Isoindolones
          • Level6 Phthalimides

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Isoindoles and derivatives
• Subclass: Isoindolines
• Intermediate Tree Nodes: Isoindolones
• Direct Parent: Phthalimides
• Alternative Parents: Alpha amino acids and derivatives Isoindoles Piperidinediones Delta lactams N-substituted carboxylic acid imides Benzenoids N-unsubstituted carboxylic acid imides Dicarboximides Tertiary amines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phthalimide - Alpha-amino acid or derivatives - Isoindole - Piperidinedione - Delta-lactam - Piperidinone - Carboxylic acid imide, n-substituted - Benzenoid - Piperidine - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Amino acid or derivatives - Lactam - Tertiary amine - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as phthalimides. These are aromatic heterocyclic compounds containing a 1,3-dioxoisoindoline moiety. They are imide derivatives of phthalic anhydrides.
• 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

• 용해성: Soluble in DMSO
• 녹는점(°C): 272-274℃ (lit.)
• 분자량: 262.250 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 262.089 Da
• Monoisotopic Mass: 262.089 Da
• Topological Polar Surface Area: 83.600 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 449.000
• Isotope Atom Count: 4
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1