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α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol

α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol structure

CAS No:
56693-13-1
Formula:
C22H32N2O3
Chemical Name:
α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol
Synonyms:
1-Piperazineethanol,α-[[(1-ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-;α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol;3517CERM;Mociprazine;CERM 3517;1-(1-Ethynyl-cyclohexyloxy)-3-[4-(2-methoxy-phenyl)-piperazin-1-yl]-propan-2-ol;112120-04-4;73211-28-6

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α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol Basic Attributes

Molecular Weight：

372.50100

Exact Mass：

372.50

EC Number：

260-340-2

Characteristics

PSA：

45.17000

XLogP3：

2.53370

Density：

1.15g/cm3

Boiling Point：

522.3ºC

Flash Point：

269.7ºC

Refractive Index：

1.581

Drug Information

MeSH Entry Terms：

3517 CERM

Computed Properties

Molecular Weight:372.5
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:372.24129289
Monoisotopic Mass:372.24129289
Topological Polar Surface Area:45.2
Heavy Atom Count:27
Complexity:489
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of α-[[(1-Ethynylcyclohexyl)oxy]methyl]-4-(2-methoxyphenyl)-1-piperazineethanol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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