AC1MHXMH

2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one;trihydrochloride

Also Known As: 4(1H)-Pyrimidinone, 2-((2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)amino)-5-((6-methyl-3-pyridinyl)methyl)-, trihydrochloride|2-[(2-{[(5-Methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)amino]-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-4(3H)-one--hydrogen chloride (1/3)|2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride

Molecular Formula	C18H25Cl3N6OS
Molecular Weight	478.08762 g/mol
LogP	3.70634
Topological Polar Surface Area	99.35 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	478.08762
Monoisotopic Mass	478.08762
Heavy Atoms	29
Complexity	916.45996

Chemical Identifiers

CAS Number	76517-95-8
SMILES	CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCSCC3=C(NC=N3)C.Cl.Cl.Cl