AC1OB3E5

5-[3-(diethylamino)propyliminomethyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one

Also Known As: (5E)-5-({[3-(diethylamino)propyl]amino}methylidene)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(5E)-5-[[3-(diethylamino)propylamino]methylidene]-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione|(E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(3,4-dimethoxyphenethyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|5-[[3-(diethylamino)propylamino]methylidene]-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Molecular Formula	C22H32N4O4S
Molecular Weight	448.21442 g/mol
LogP	3.02219
Topological Polar Surface Area	92.08 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	12
Exact Mass	448.21442
Monoisotopic Mass	448.21442
Heavy Atoms	31
Complexity	995.981

Chemical Identifiers

CAS Number	674294-53-2
SMILES	CCN(CC)CCCN=CC1=C(N(C(=S)NC1=O)CCC2=CC(=C(C=C2)OC)OC)O