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Tubulin Polymerization Inhibitor AEZS 112

HCID 9843752
ノート反応
基本情報概要名称と識別子物性化学と産業関連反応化合物ノート
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基本情報

CAS
1214741-69-1
標準SMILES
COc1cccc(N2CCN(C(=O)c3c4ccccc4nc4ccccc34)CC2)c1
InChIKey
YTECZQLINBWBIQ-UHFFFAOYSA-N
分子式
C25H23N3O2
平均分子量
397.5 g/mol
単同位体質量
397.17902698

概要

ZEN-012 is a novel small molecule and the first anti-cancer drug in development involving two mechanisms of action: tubulin and topoisomerase II inhibition. ZEN-012 also expresses additional modes of action such as pro-apoptotic and anti-angiogenic properties. It is developed for the treatment of solid tumors.

名称と識別子

優先名称
Tubulin Polymerization Inhibitor AEZS 112
IUPAC
acridin-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

名称と別名

AEZS-1121214741-69-1AEZS112ZEN012RefChem:900707AEZS 112ZEN 012ZEN-012Tubulin Polymerization Inhibitor AEZS 112MRH9DH8ZNRUNII-MRH9DH8ZNRAEZS-112 [WHO-DD]
名称をさらに表示
848084-59-3Piperazine, 1-(9-acridinylcarbonyl)-4-(3-methoxyphenyl)-Acridin-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone9-Acridinyl[4-(3-methoxyphenyl)-1-piperazinyl]methanoneAEZS 112 [WHO-DD]SCHEMBL18854912Methanone, 9-acridinyl[4-(3-methoxyphenyl)-1-piperazinyl]-

データベース識別子

CAS
1214741-69-1、848084-59-3
PubChem CID
9843752
UNII
MRH9DH8ZNR

物性

構造計算による物性

XLogP
4.6
極性表面積
45.7 Ų
水素結合供与体数
0
水素結合受容体数
4
回転可能結合数
3
重原子数
30
形式電荷
0
複雑度
569

化学と産業

薬理情報

Pharmacodynamics · 1 件

In vitro: ZEN-012 has shown potent in vitro anti-proliferative activity at nanomolar concentrations against human tumor cell lines of different origin. ZEN-012 is active in tumor cell lines which are resistant to cisplatin and doxorubicin as well as to tubulin inhibitors such as vincristine and paclitaxel. Furthermore, it was shown thatZEN-012 is a catalytic inhibitor of the enzyme topoisomerase II with the same potency as amsacrine. In vivo: Given orally once or twice weekly, ZEN-012 proved to be a potent inhibitor of in vivo tumor growth in mammary, lung, renal, colon, melanoma xenograft models as well as in leukemia cancer models at well tolerated doses (16-40mg/kg). Furthermore,ZEN-012 showed good safety and toxicity profiles in a series of rodent and non-rodent studies.

Mechanism of Action · 1 件

Mode of action studies revealed that the compound ZEN-012 inhibits the polymerization of ß-tubulin in low micromolar concentrations. Competition studies suggest that ZEN-012 interacts with the same binding site on microtubules as colchicine. ZEN-012 destroys the mitotic spindles of the cancer cells, arrests the cancer cells in G2/M phase at low concentrations, mediates DNA fragmentation via inhibition of topoisomerase II and induces apoptosis via various mechanisms.

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