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Isbogrel

Isbogrel structure

CAS No:
89667-40-3
Formula:
C18H19NO2
Chemical Name:
Isbogrel
Synonyms:
6-Heptenoic acid,7-phenyl-7-(3-pyridinyl)-,(6E)-;6-Heptenoic acid,7-phenyl-7-(3-pyridinyl)-,(E)-;(6E)-7-Phenyl-7-(3-pyridinyl)-6-heptenoic acid;CV 4151;Isbogrel
Categories:
Active Pharmaceutical Ingredients > Blood System Drugs

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Isbogrel Basic Attributes

Molecular Weight：

281.35

Exact Mass：

281.35

DSSTox ID：

DTXSID80275693

HScode：

2933399090

Characteristics

PSA：

50.2

XLogP3：

4.15830

Density：

1.122g/cm3

Melting Point：

114-115 °C

Boiling Point：

481.7ºC at 760 mmHg

Flash Point：

245.1ºC

Refractive Index：

1.579

Drug Information

MeSH：

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)|Fibrinolysin or agents that convert plasminogen to FIBRINOLYSIN. (See all compounds classified as Fibrinolytic Agents.)

MeSH Entry Terms：

7-phenyl-7-(3-pyridyl)-6-heptenoic acid

Isbogrel Use and Manufacturing

Thromboxane A2 inhibitor. Used to treat short-term myocardial ischemia.

Computed Properties

Molecular Weight:281.3
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:281.141578849
Monoisotopic Mass:281.141578849
Topological Polar Surface Area:50.2
Heavy Atom Count:21
Complexity:345
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes