CDK9-IN-1 - ≥98% , CAS No.1415559-43-1

CAS: 1415559-43-1 Cat. No.: C651048 분자식: C₂₆H₂₁N₅O₄S 분자량: 499.54 PubChem CID: 66577006

GRADE & PURITY ≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

개요

CDK9-IN-1 is a novel, selective CDK9 inhibitor for the treatment of HIV infection , with an IC 50 of 39 nM for CDK9/CycT1

In Vitro

CDK9-IN-1 is a potent CDK9 inhibitor that shows high activity against HIV-1 replication. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:CDK9/CycT1 39 nM (IC 50 )

Specifications

사양 및 순도

≥98%

생화학 및 생리적 메커니즘

CDK9-IN-1 is a novel, selective CDK9 inhibitor for the treatment of HIV infection , with an IC 50 of 39 nM for CDK9/CycT1, extracted from reference, compound 87.

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

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작업 유형

INHIBITOR

순수함

≥98%

이름과 식별자

• 이성체 SMILES: CC1=C(C=C(C=C1)NC2=NC=NC(=C2)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)NS(=O)(=O)C
• PubChem CID: 66577006
• 분자량: 499.54

작용 메커니즘

화학 및 물리적 특성

• 용해성: DMSO : 100 mg/mL (200.18 mM; Need ultrasonic)
• 분자량: 499.500 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 499.131 Da
• Monoisotopic Mass: 499.131 Da
• Topological Polar Surface Area: 130.000 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 900.000
• 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