Name: AZD5153 6-Hydroxy-2-naphthoic acid
Rating: 5 (10 reviews)

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HIT ID:HIT212036694
Cas No:1869912-40-2
常用名:AZD5153 6-Hydroxy-2-naphthoic acid
常用名:AZD5153 6-Hydroxy-2-naphthoic acid
别名:AZD5153结晶体(API形式), AZD-5153 HNT salt, AZD5153
别名:AZD5153结晶体(API形式), AZD-5153 HNT salt, AZD5153
IUPAC:(3R)-4-{2-[4-(1-{3-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}piperidin-4-yl)phenoxy]ethyl}-1,3-dimethylpiperazin-2-one; 6-hydroxynaphthalene-2-carboxylic acid
IUPAC:(3R)-4-{2-[4-(1-{3-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}piperidin-4-yl)phenoxy]ethyl}-1,3-dimethylpiperazin-2-one; 6-hydroxynaphthalene-2-carboxylic acid
InChI key:UNZQBHXKCHECEC-GMUIIQOCSA-N

分子式:C36H41N7O6
分子量:667.767
氢键供体数 (HBD):0
氢键受体数 (HBA):8
LogP:2.5693958
SMILES:OC(=O)c1ccc2cc(O)ccc2c1.COc1nnc2ccc(nn12)N1CCC(CC1)c1ccc(OCCN2CCN(C)C(=O)[C@H]2C)cc1
SMILES:OC(=O)c1ccc2cc(O)ccc2c1.COc1nnc2ccc(nn12)N1CCC(CC1)c1ccc(OCCN2CCN(C)C(=O)[C@H]2C)cc1

AZD5153 6-Hydroxy-2-naphthoic acid (AZD5153) 是 AZD5153的6-羟基-2-萘甲酸盐形式。AZD5153是一种有口服活性的选择性 BET/BRD4溴结构域抑制剂，对BRD4的IC50值为1.7nM。

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