Name: Topixantrone
Rating: 5 (10 reviews)

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HIT ID:HIT212713802
Cas No:156090-18-5
常用名:Topixantrone
别名:BBR-3576, BBR3576, BBR 3576
IUPAC:10-{[2-(dimethylamino)ethyl]amino}-14-{2-[(2-hydroxyethyl)amino]ethyl}-4,14,15-triazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-8-one
IUPAC:10-{[2-(dimethylamino)ethyl]amino}-14-{2-[(2-hydroxyethyl)amino]ethyl}-4,14,15-triazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-8-one
InChI key:ZHAKYGFJVGCOAE-UHFFFAOYSA-N

分子式:C21H26N6O2
分子量:394.479
氢键供体数 (HBD):3
氢键受体数 (HBA):7
LogP:0.8084115
SMILES:CN(C)CCNc1ccc2n(CCNCCO)nc3-c4cnccc4C(=O)c1c23
SMILES:CN(C)CCNc1ccc2n(CCNCCO)nc3-c4cnccc4C(=O)c1c23

Topixantrone, a DNA topoisomerase inhibitor, is used potentially for the treatment of gastric cancer and prostate cancer.

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