Name: Sadopine
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212718129
Cas No:111127-62-9
常用名:Sadopine
IUPAC:3-[2-(2-{[(tert-butoxy)carbonyl]amino}-4-(methylsulfanyl)butanamido)ethyl] 5-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC:3-[2-(2-{[(tert-butoxy)carbonyl]amino}-4-(methylsulfanyl)butanamido)ethyl] 5-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
InChI key:IAGRRCQYHMPXJH-UHFFFAOYSA-N

分子式:C30H40F3N3O7S
分子量:643.72
氢键供体数 (HBD):3
氢键受体数 (HBA):5
LogP:3.9201894
SMILES:CCOC(=O)C1=C(C)NC(C)=C(C1c1ccccc1C(F)(F)F)C(=O)OCCNC(=O)C(CCSC)NC(=O)OC(C)(C)C |c:5,10|
SMILES:CCOC(=O)C1=C(C)NC(C)=C(C1c1ccccc1C(F)(F)F)C(=O)OCCNC(=O)C(CCSC)NC(=O)OC(C)(C)C |c:5,10|

Sadopine is an excellent high affinity, high specific activity radioligand to label selectively the DHP receptor of L-type Ca2+ channels in tissue sections as well as in membrane fragments.

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