HCID59924507

3(R)-(3-biphenyl-4-yl-1H-pyrol-1-yl)-N-[1(S)-(N-methoxy-N-methylcarbamoyl)-3-methyl-butyl]succinamic acid benzyl ester

benzyl (3R)-4-[[(2S)-1-[methoxy(methyl)amino]-4-methyl-1-oxopentan-2-yl]amino]-4-oxo-3-[3-(4-phenylphenyl)pyrrol-1-yl]butanoate

C35H39N3O5581.7 g/mol

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IDENTITY

结构与身份

标准 SMILES: CON(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(=O)OCc1ccccc1)n1ccc(-c2ccc(-c3ccccc3)cc2)c1
InChIKey: AKNRWNXUIBFQNU-AJQTZOPKSA-N
分子式: C35H39N3O5
平均分子量: 581.7 g/mol
单同位素质量: 581.28897135

COMPUTED

结构计算性质

已同步

XLogP: 6
极性表面积: 89.9 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 14
重原子: 43
形式电荷: 0
复杂度: 877

ALIASES

名称与别名

共 5 条

SCHEMBL7609990AKNRWNXUIBFQNU-AJQTZOPKSA-N3(R)-(3-biphenyl-4-yl-1H-pyrol-1-yl)-N-[1(S)-(N-methoxy-N-methylcarbamoyl)-3-methyl-butyl]succinamic acid benzyl ester3(R)-(3-Biphenyl-4-yl-1H-pyrrol-1-yl)-N-[1(S)-(N-methoxy-N-methylcarbamoyl)-3-methyl- butyl]succinamic Acid Benzyl Ester3(R)-(3-biphenyl-4-yl-1H-pyrrol-1-yl)-N-[1(S)-(N-methoxy-N-methylcarbamoyl)-3-methyl-butyl]succinamic acid benzyl ester

REACTIONS