AC1NXYAP

(6Z)-5-imino-6-[[1-(3-phenoxypropyl)indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Also Known As: (6Z)-5-imino-6-[[1-(3-phenoxypropyl)indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6Z)-5-imino-6-{[1-(3-phenoxypropyl)-1H-indol-3-yl]methylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-5-imino-6-((1-(3-phenoxypropyl)-1H-indol-3-yl)methylene)-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one

Molecular Formula	C28H22N6O2S
Molecular Weight	506.1525 g/mol
LogP	5.17287
Topological Polar Surface Area	95.93 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	506.1525
Monoisotopic Mass	506.1525
Heavy Atoms	37
Complexity	1590.9866

Chemical Identifiers

CAS Number	844654-77-9
SMILES	C1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)/C=C\4/C(=N)N5C(=NC4=O)SC(=N5)C6=CN=CC=C6