C27H22ClN5O3S

(6Z)-6-[[3-chloro-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Also Known As: (6Z)-6-[[3-chloro-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6Z)-6-{3-chloro-5-ethoxy-4-[(3-methylbenzyl)oxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-6-(3-chloro-5-ethoxy-4-((3-methylbenzyl)oxy)benzylidene)-5-imino-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one

Molecular Formula	C27H22ClN5O3S
Molecular Weight	531.11316 g/mol
LogP	5.68859
Topological Polar Surface Area	100.23 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	531.11316
Monoisotopic Mass	531.11316
Heavy Atoms	37
Complexity	1486.6119

Chemical Identifiers

CAS Number	577787-80-5
SMILES	CCOC1=C(C(=CC(=C1)/C=C\2/C(=N)N3C(=NC2=O)SC(=N3)C4=CN=CC=C4)Cl)OCC5=CC=CC(=C5)C