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4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride

4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride structure

CAS No:
170911-68-9
Formula:
C23H26ClN5O2
Chemical Name:
4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride
Synonyms:
Donitriptan hydrochloride; Donitriptan monohydrochloride; Nafadotride;
Categories:
Organic Chemistry > Amides

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4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride Basic Attributes

Molecular Weight：

439.93800

Exact Mass：

439.1775028 g/mol

UNII：

XTD13T14MR

DSSTox ID：

DTXSID60168973

Characteristics

PSA：

98.38000

XLogP3：

3.77358

Boiling Point：

727.1ºC

Flash Point：

393.6ºC

Vapor Pressure：

5.34E-21mmHg at 25°C

Drug Information

MeSH Entry Terms：

4-(4-(2-(2-aminoethyl-1H-indol-5-yloxyl)acetyl)piperazinyl-1-yl)benzonitrile

Computed Properties

Molecular Weight:439.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:439.1775028
Monoisotopic Mass:439.1775028
Topological Polar Surface Area:98.4
Heavy Atom Count:31
Complexity:618
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Latest News on 4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride

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Guide of 4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile,hydrochloride

Basic Attributes
Characteristics
Drug Information
Computed Properties
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