AC1L86JO

3-[4-(dimethylamino)phenyl]-1,6-dimethyl-4-oxidopyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione

Also Known As: Pyrimido(5,4-e)-1,2,4-triazine-5,7(1H,6H)-dione, 3-(4-(dimethylamino)phenyl)-1,6-dimethyl-, 4-oxide|2-Cyclohexen-1-one,4-(3-hydroxybutylidene)-3,5,5-trimethyl|3-[4-(dimethylamino)phenyl]-1,6-dimethyl-4-oxidopyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione|Pyrimido[5,4-e]-1,2,4-triazine-5,7(1H,6H)-dione, 3-[4-(dimethylamino)phenyl]-1,6-dimethyl-, 4-oxide|3-(4-dimethylaminophenyl)-1,6-dimethyl-4-oxido-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione|3-(4-dimethylaminophenyl)-1,6-dimethyl-4-oxidopyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione|3-[4-(Dimethylamino)phenyl]-1,6-dimethyl-4-oxo-4lambda~5~-pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione

Molecular Formula	C15H16N6O3
Molecular Weight	328.1284 g/mol
LogP	-0.1
Topological Polar Surface Area	97.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	328.1284
Monoisotopic Mass	328.1284
Heavy Atoms	24
Complexity	673.0

Chemical Identifiers

CAS Number	60026-35-9
SMILES	CN1C2=NC(=O)N(C(=O)C2=[N+](C(=N1)C3=CC=C(C=C3)N(C)C)[O-])C
InChIKey	ILVOJIZQNHJCFD-UHFFFAOYSA-N