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Eptapirone

Eptapirone structure

CAS No:
179756-85-5
Formula:
C16H23N7O2.C4H4O4
Chemical Name:
Eptapirone
Synonyms:
1,2,4-Triazine-3,5(2H,4H)-dione,4-methyl-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-,(2E)-2-butenedioate (1:1);1,2,4-Triazine-3,5(2H,4H)-dione,4-methyl-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-,(E)-2-butenedioate (1:1);Eptapirone

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Description

Eptapirone is a N-arylpiperazine.

Eptapirone Basic Attributes

Molecular Weight：

345.40000

Exact Mass：

345.19132300 g/mol

UNII：

3M824XRO8N

DSSTox ID：

DTXSID40170857

Characteristics

PSA：

89.15000

XLogP3：

-0.66270

Density：

1.35g/cm3

Boiling Point：

517.4ºC

Flash Point：

266.7ºC

Refractive Index：

1.666

Vapor Pressure：

8.24E-11mmHg at 25°C

Drug Information

MeSH Entry Terms：

4-methyl-2-(4-(4-(pyrimidin-2-yl)piperazino)butyl)-2H,4H-1,2,4-triazin-3,5-dione

Computed Properties

Molecular Weight:345.40
XLogP3:0.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:345.19132300
Monoisotopic Mass:345.19132300
Topological Polar Surface Area:85.2
Heavy Atom Count:25
Complexity:499
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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EPTAPIRONE

179756-58-2

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Guide of Eptapirone

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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