1H-Pyrrole-1-propanamide, 4-[[[(3,4-dichlorophenyl)methyl]methylamino]carbonyl]-2,5-dihydro-3-hydroxy-2-oxo- 分子结构式
HCID54698209

1H-Pyrrole-1-propanamide, 4-[[[(3,4-dichlorophenyl)methyl]methylamino]carbonyl]-2,5-dihydro-3-hydroxy-2-oxo-

1-(3-amino-3-oxopropyl)-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-N-methyl-5-oxo-2H-pyrrole-3-carboxamide

C16H17Cl2N3O4386.2 g/mol

IDENTITY

结构与身份

标准SMILES
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1=C(O)C(=O)N(CCC(N)=O)C1
InChIKey
UVQNUPDHKWOOMT-UHFFFAOYSA-N
分子式
C16H17Cl2N3O4
平均分子量
386.2 g/mol
单同位素质量
385.0596114

COMPUTED

结构计算性质

已同步
XLogP
1
极性表面积
104 Ų
氢键供体
2
氢键受体
4
可旋转键
6
重原子
25
形式电荷
0
复杂度
596

ALIASES

名称与别名

共 4 条
UVQNUPDHKWOOMT-UHFFFAOYSA-N1-(2-Carbamoyl-ethyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylic acid (3,4-dichloro-benzyl)-methyl-amide1-(3-amino-3-oxo-propyl)-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-N-methyl-5-oxo-2H-pyrrole-3-carboxamide1H-Pyrrole-1-propanamide, 4-[[[(3,4-dichlorophenyl)methyl]methylamino]carbonyl]-2,5-dihydro-3-hydroxy-2-oxo-

REACTIONS

相关反应

2
HRID 822407 反应方程式

Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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HRID 2214537 反应方程式

uspto-grants-2006_09 · 10.6084/m9.figshare.5104873.v1 · US07109186B2

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