ZA5TVD7MX5

3-benzyl-2-butylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione

Also Known As: NCGC00247225-01|1H-Imidazo(4,5-d)pyridazine-4,7-dione, 2-(butylthio)-5,6-dihydro-1-(phenylmethyl)-|1-benzyl-2-(butylsulfanyl)-5,6-dihydro-1h-imidazo[4,5-d]pyridazine-4,7-dione|3-benzyl-2-butylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione|1-Benzyl-2-(butylthio)-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione|3-benzyl-2-butylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine|1-benzyl-2-(butylsulfanyl)-1H-imidazo[4,5-d]pyridazine-4,7-diol|2-(Butylthio)-5,6-dihydro-1-(phenylmethyl)-1H-imidazo(4,5-d)pyridazine-4,7-dione|2-Butylmercapto-1-benzyl-4,7-dihydroxy-1H-imidazo<4,5-d>pyridazin|1H-IMIDAZO(4,5-D)PYRIDAZINE-4,7-DIOL, 1-BENZYL-2-(BUTYLTHIO)-|1H-Imidazo[4,5-d]pyridazine-4,7-dione, 2-(butylthio)-5,6-dihydro-1-(phenylmethyl)-

Molecular Formula	C16H18N4O2S
Molecular Weight	330.11505 g/mol
LogP	2.9
Topological Polar Surface Area	101.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	330.11505
Monoisotopic Mass	330.11505
Heavy Atoms	23
Complexity	442.0

Chemical Identifiers

CAS Number	34545-87-4
SMILES	CCCCSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NNC2=O
InChIKey	KVUMLIVRLQVRNW-UHFFFAOYSA-N