Vc-seco-DUBA - ≥99% , CAS No.1345681-58-4

CAS: 1345681-58-4 Cat. No.: V651575 분자식: C₆₅H₇₅ClN₁₂O₁₇ 분자량: 1331.81 EC 번호: 813-138-9 PubChem CID: 88899540

GRADE & PURITY ≥99%

Storage

Protected from light,Argon charged,Store at -80°C

Shipped In

Dry ice packs + Cold packs

개요

Vc-seco-DUBA (SYD985) is a agent-linker conjugate for ADC with potent antitumor activity by using DUBA (DNA alkylating agent), linked via the ADC linker Vc-seco

Form:Solid

IC50& Target:Duocarmycins

Specifications

사양 및 순도

≥99%

생화학 및 생리적 메커니즘

Vc-seco-DUBA (SYD985) is a agent-linker conjugate for ADC with potent antitumor activity by using DUBA (DNA alkylating agent), linked via the ADC linker Vc-seco.

보관 조건

Protected from light,Argon charged,Store at -80°C

배송

Dry ice packs + Cold packs

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순수함

≥99%

이름과 식별자

정식 스마일

CC1=C2C(=CC=C1)C(=CC3=C2[C@@H](CN3C(=O)C4=CN5C=C(C=CC5=N4)NC(=O)C6=CC=C(C=C6)O)CCl)OC(=O)N(CCN(C)C(=O)OCC7=CC=C(C=C7)NC(=O)[C@H](CCCNC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)OCCOCCN8C(=O)C=CC8=O)CCOCCO

이성체 SMILES

CC1=C2C(=CC=C1)C(=CC3=C2[C@@H](CN3C(=O)C4=CN5C=C(C=CC5=N4)NC(=O)C6=CC=C(C=C6)O)CCl)OC(=O)N(CCN(C)C(=O)OCC7=CC=C(C=C7)NC(=O)[C@H](CCCNC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)OCCOCCN8C(=O)C=CC8=O)CCOCCO

PubChem CID

88899540

분자량

1331.81

화학 및 물리적 특성

• 용해성: DMSO : 146.67 mg/mL (110.13 mM; ultrasonic and warming and heat to 60°C)
• 분자량: 1331.800 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 34
• Exact Mass: 1330.51 Da
• Monoisotopic Mass: 1330.51 Da
• Topological Polar Surface Area: 374.000 Ų
• Heavy Atom Count: 95
• Formal Charge: 0
• Complexity: 2630.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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