AC1O1SY6

(E)-2-(1,3-benzothiazol-2-yl)-3-[2-(2,3-dimethylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile

Also Known As: NCGC00101385-01|(2E)-2-(1,3-benzothiazol-2-yl)-3-[2-(2,3-dimethylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile|(E)-2-(1,3-benzothiazol-2-yl)-3-[2-(2,3-dimethylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile|(E)-2-(benzo[d]thiazol-2-yl)-3-(2-(2,3-dimethylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile

Molecular Formula	C26H18N4O2S
Molecular Weight	450.11505 g/mol
LogP	5.77752
Topological Polar Surface Area	80.28 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	450.11505
Monoisotopic Mass	450.11505
Heavy Atoms	33
Complexity	1624.105

Chemical Identifiers

CAS Number	620109-35-5
SMILES	CC1=C(C(=CC=C1)OC2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/C4=NC5=CC=CC=C5S4)C