SRT3657
HIT212670501
sdf文件结构编辑类似物检索
HIT ID: HIT212670501
Cas No: 1383551-17-4
分子式: C40H54N8O6S
分子量: 774.98
常用名: SRT3657
氢键受体数 (HBA): 9
氢键供体数 (HBD): 2
LogP: 6.4568586
IUPAC: tert-butyl 4-{[2-(2-{6-[(2-{[(tert-butoxy)carbonyl](methyl)amino}ethyl)amino]-2-butylpyrimidine-4-amido}phenyl)-[1,3]thiazolo[5,4-b]pyridin-6-yl]methoxy}piperidine-1-carboxylate
IUPAC: tert-butyl 4-{[2-(2-{6-[(2-{[(tert-butoxy)carbonyl](methyl)amino}ethyl)amino]-2-butylpyrimidine-4-amido}phenyl)-[1,3]thiazolo[5,4-b]pyridin-6-yl]methoxy}piperidine-1-carboxylate
SMILES: CCCCc1nc(NCCN(C)C(=O)OC(C)(C)C)cc(n1)C(=O)Nc1ccccc1-c1nc2cc(COC3CCN(CC3)C(=O)OC(C)(C)C)cnc2s1
SMILES: CCCCc1nc(NCCN(C)C(=O)OC(C)(C)C)cc(n1)C(=O)Nc1ccccc1-c1nc2cc(COC3CCN(CC3)C(=O)OC(C)(C)C)cnc2s1
InChI key: IXROIZHATNMRLR-UHFFFAOYSA-N
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