Isbogrel

(E)-7-phenyl-7-pyridin-3-ylhept-6-enoic acid

Also Known As: Isbogrel|Isbogrelum|Isbogrel [INN]|Antexan|Cv-4151|Isbogrelum [INN-Latin]|ISBOGREL [JAN]|ISBOGREL [MI]|(E)-ISBOGREL|(E)-7-Phenyl-7-(pyridin-3-yl)hept-6-enoic acid|CV 4151|(E)-7-phenyl-7-pyridin-3-ylhept-6-enoic acid|(E)-7-Phenyl-7-(3-pyridinyl)-6-heptenoic acid|Tox21_111756|NCGC00160351-01|(E)-7-Phenyl-7-(3-pyridyl)-6-heptenoic acid|7-Phenyl-7-(3-pyridyl)-6-heptenoic acid|(6E)-7-phenyl-7-(pyridin-3-yl)hept-6-enoic acid|CAS-89667-40-3|(6E)-7-phenyl-7-pyridin-3-ylhept-6-enoic acid|6-Heptenoic acid, 7-phenyl-7-(3-pyridinyl)-, (E)-|7-Phenyl-7-pyridin-3-yl-hept-6-enoic acid|A-66900

Molecular Formula	C18H19NO2
Molecular Weight	281.14157 g/mol
LogP	4.1583
Topological Polar Surface Area	50.19 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	7
Exact Mass	281.14157
Monoisotopic Mass	281.14157
Heavy Atoms	21
Complexity	549.63007

Chemical Identifiers

CAS Number	89667-40-3
SMILES	C1=CC=C(C=C1)/C(=C\CCCCC(=O)O)/C2=CN=CC=C2