KKII5 - Moligand™,≥98% , CAS No.6381-55-1

CAS: 6381-55-1 Cat. No.: K649315 분자식: C₁₆H₁₄N₂S 분자량: 266.36 PubChem CID: 2725891

GRADE & PURITY Moligand™, ≥98%

Synonyms

4,6-Diphenyl-1,2,3,4-Tetrahydropyrimidine-2-Thione | 4,6-Diphenyl-3,4-dihydropyrimidine-2(1H)-thione

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

개요

KKII5 is a potent Lipoxygenase ( LOX-1 ) inhibitor with an IC 50 of 19 μM. KKII5 inhibits lipid peroxidation

In Vitro

KKII5 interacts with HIS499 of the cavity by forming one π–π stacking interaction between the phenyl ring of the molecule and the imidazole ring of HIS499. KKII5 (100 μM) strongly inhibits lipid peroxidation with 98% inhibition. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:IC50: 19 μM (LOX-1)

Specifications

동의어

4,6-Diphenyl-1,2,3,4-Tetrahydropyrimidine-2-Thione | 4,6-Diphenyl-3,4-dihydropyrimidine-2(1H)-thione

사양 및 순도

Moligand™,≥98%

생화학 및 생리적 메커니즘

KKII5 is a potent Lipoxygenase ( LOX-1 ) inhibitor with an IC 50 of 19 μM. KKII5 inhibits lipid peroxidation.

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

등급

Moligand™

작업 유형

INHIBITOR

순수함

≥98%

이름과 식별자

• 이성체 SMILES: C1=CC=C(C=C1)C2C=C(NC(=S)N2)C3=CC=CC=C3
• PubChem CID: 2725891
• 분자량: 266.36

화학 및 물리적 특성

• 분자량: 266.400 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 266.088 Da
• Monoisotopic Mass: 266.088 Da
• Topological Polar Surface Area: 56.200 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 352.000
• Isotope Atom Count: 0
• 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