AC1OAMRL

1-[(4-fluorophenyl)methyl]-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one

Also Known As: (E)-1-(4-fluorobenzyl)-5-(((3-hydroxypropyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|(5E)-1-(4-fluorobenzyl)-5-{[(3-hydroxypropyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(5E)-1-[(4-fluorophenyl)methyl]-5-[(3-hydroxypropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|1-[(4-fluorophenyl)methyl]-5-[(3-hydroxypropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Molecular Formula	C15H16FN3O3S
Molecular Weight	337.08963 g/mol
LogP	1.60019
Topological Polar Surface Area	90.61 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	337.08963
Monoisotopic Mass	337.08963
Heavy Atoms	23
Complexity	812.1973

Chemical Identifiers

CAS Number	714245-96-2
SMILES	C1=CC(=CC=C1CN2C(=C(C(=O)NC2=S)C=NCCCO)O)F