Tasquinimod

HCID 54682876
노트반응
부분 구조 검색유사 구조 찾기

기본 정보

CAS
254964-60-8
표준 SMILES
COc1cccc2c1c(O)c(C(=O)N(C)c1ccc(C(F)(F)F)cc1)c(=O)n2C
InChIKey
ONDYALNGTUAJDX-UHFFFAOYSA-N
분자식
C20H17F3N2O4
평균 분자량
406.4 g/mol
단동위원소 질량
406.11404168

개요

Tasquinimod is a quinoline-3-carboxamide linomide analogue with antiangiogenic and potential antineoplastic activities. Tasquinimod has been shown to decrease blood vessel density but the exact mechanism of action is not known. This agent has also been shown to augment the antineoplastic effects of docetaxel and androgen ablation in a murine model of prostate cancer involving human prostate cancer xenografts.

이름 및 식별자

우선 이름
Tasquinimod
IUPAC
4-hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide
영어명
tasquinimod
분자식
C20H17F3N2O4
분자량
406.36

이름 및 동의어

Tasquinimod254964-60-8ABR-215050TASQ4-hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide4-Hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-(4-(trifluoromethyl)phenyl)-1,2-dihydroquinoline-3-carboxamideDTXSID90180183756U07KN1R4-Hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-[4-(trifluoromethyl)phenyl]-1,2-dihydroquinoline-3-carboxamidetasquinimodum4-hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-(4-(trifluoromethyl)phenyl)quinoline-3-carboxamideRefChem:891191
이름 더 보기
TASQ)Tasquinimod, >98%Tasquinimod (Standard)Tasquinimod(ABR-215050)Tasquinimod, 10 mM in DMSO7-diMethoxy-4-quinolinyl)oxy]-ABR215050ABR 2150507-Dimethoxy-quinolin-4-yloxy)-phenylamine
DTXCID00102674Tasquinimod [INN]MFCD18251454UNII-756U07KN1R4-Hydroxy-5-methoxy-N,1-dimethyl-2-oxo-N-(4-(trifluoromethyl)-phenyl)-1,2-dihydroquinoline-3-carboxamideAC-32481N-Methyl-N-(4-trifluoromethyl-phenyl)-1,2-dihydro-4-hydroxy-5-methoxy-1-methyl-2-oxo-quinoline-3-carboxamide4-Hydroxy-5-methoxy-N

데이터베이스 식별자

CAS
254964-60-8
PubChem CID
54682876
DTXSID
DTXSID90180183
ChEMBL
CHEMBL2107784
ChEBI
CHEBI:231355
UNII
756U07KN1R
Nikkaji
J2.975.990A

물성

구조 계산 물성

XLogP
3.5
극성 표면적
70.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
3
무거운 원자 수
29

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15

물리화학적 성질

끓는 점
501.5 · 501.5±50.0 °C(Predicted)
밀도
1.427 · 1.427±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
용해도
2 O; · insoluble in H2O; ≥20.32 mg/mL in DMSO; ≥4.75 mg/mL in EtOH with gentle warming and ultrasonic
물리적 상태
고체
산도 계수 (pKa)
4.5 · 4.50±1.00(Predicted)

안전 및 규제

안전 데이터

wgk
WGK 3
스토리지 클래스
11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

개요Tasquinimod is an orally-active quinoline-3-carboxamide derived from roquinimex, an immunomodulatory quinolone with applications in some cancers and autoimmune diseases. Tasquinimod inhibits tumor angiogenesis and supplements radiation or chemotherapy in animal models of prostate cancer. While its precise mechanism of action remains unclear, tasquinimod has been reported to alter signaling through S100A9, thrombospondin-1, HIF-1α, androgen receptor, VEGF, and HDAC3/4.

용도Tasquinimod is an orally active antiangiogenic agent which may inhibit HDAC4 signalling. This affects cancer cell survival thus making this compound and anti-cancer agent.

상·하류 제품 정보

공급사85 곳

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

관련 반응

4건
반응 기록 만들기

화합물 노트

불러오는 중…