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Pimefylline

Pimefylline structure

CAS No:
10001-43-1
Formula:
C15H18N6O2
Chemical Name:
Pimefylline
Synonyms:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[(3-pyridinylmethyl)amino]ethyl]-;Theophylline,7-[2-[(3-pyridylmethyl)amino]ethyl]-;3,7-Dihydro-1,3-dimethyl-7-[2-[(3-pyridinylmethyl)amino]ethyl]-1H-purine-2,6-dione;Pimephylline;Pimefylline;ES 771

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Description

Pimefylline is an oxopurine.

Pimefylline Basic Attributes

Molecular Weight：

314.34200

Exact Mass：

314.34

EC Number：

600-017-9

UNII：

8680B5Y37A

DSSTox ID：

DTXSID30142861

HScode：

2933990090

Characteristics

PSA：

86.74000

XLogP3：

0.00940

Density：

1.37g/cm3

Melting Point：

111-112 °C

Boiling Point：

575.6ºC

Flash Point：

301.9ºC

Refractive Index：

1.682

Vapor Pressure：

3E-13mmHg at 25°C

Drug Information

MeSH Entry Terms：

7-(2-(3-pyridylmethylamino)-ethyl)theophylline

Computed Properties

Molecular Weight:314.34
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:314.14912384
Monoisotopic Mass:314.14912384
Topological Polar Surface Area:83.4
Heavy Atom Count:23
Complexity:459
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Pimefylline

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

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