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2-(3,4-dichlorophenyl)-1-[2-[(3-hydroxypyrrolidin-1-yl)methyl]-4,4-dimethylpiperidin-1-yl]ethanone

2-(3,4-dichlorophenyl)-1-[2-[(3-hydroxypyrrolidin-1-yl)methyl]-4,4-dimethylpiperidin-1-yl]ethanone structure

CAS No:
157000-71-0
Formula:
C20H28Cl2N2O2
Chemical Name:
2-(3,4-dichlorophenyl)-1-[2-[(3-hydroxypyrrolidin-1-yl)methyl]-4,4-dimethylpiperidin-1-yl]ethanone
Synonyms:
1-((3,4-Dichlorophenyl)acetyl)-2-((3-hydroxy-1-pyrrolidinyl)methyl)-4,4-dimethylpiperidine;

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2-(3,4-dichlorophenyl)-1-[2-[(3-hydroxypyrrolidin-1-yl)methyl]-4,4-dimethylpiperidin-1-yl]ethanone Basic Attributes

Molecular Weight：

399.35500

Exact Mass：

398.1527835 g/mol

Characteristics

PSA：

43.78000

XLogP3：

3.49550

Density：

1.239g/cm3

Boiling Point：

549.6ºC

Flash Point：

286.2ºC

Refractive Index：

1.57

Vapor Pressure：

6.48E-13mmHg at 25°C

Drug Information

MeSH Entry Terms：

1-((3,4-dichlorophenyl)acetyl)-2-((3-hydroxy-1-pyrrolidinyl)methyl)-4,4-dimethylpiperidine

Computed Properties

Molecular Weight:399.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:398.1527835
Monoisotopic Mass:398.1527835
Topological Polar Surface Area:43.8
Heavy Atom Count:26
Complexity:502
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3,4-dichlorophenyl)-1-[2-[(3-hydroxypyrrolidin-1-yl)methyl]-4,4-dimethylpiperidin-1-yl]ethanone

Basic Attributes
Characteristics
Drug Information
Computed Properties

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