AC1OOAGZ

(6E)-6-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-5-imino-2-methylsulfanyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Also Known As: (6E)-6-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-5-imino-2-(methylsulfanyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6E)-6-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-5-imino-2-methylsulfanyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(E)-6-((2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene)-5-imino-2-(methylthio)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one

Molecular Formula	C19H17N5OS2
Molecular Weight	395.08746 g/mol
LogP	4.03381
Topological Polar Surface Area	73.81 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	395.08746
Monoisotopic Mass	395.08746
Heavy Atoms	27
Complexity	1049.5524

Chemical Identifiers

CAS Number	844653-91-4
SMILES	CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/3\C(=N)N4C(=NC3=O)SC(=N4)SC