AC1M00HF

4-ethyl-5-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Also Known As: 3-ethyl-2-((2-(4-fluorophenyl)-2-oxoethyl)thio)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one|3-ethyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

Molecular Formula	C20H20FN3O2S2
Molecular Weight	417.09808 g/mol
LogP	3.5799
Topological Polar Surface Area	55.2 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	417.09808
Monoisotopic Mass	417.09808
Heavy Atoms	28
Complexity	1105.3217

Chemical Identifiers

CAS Number	577789-46-9
SMILES	CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)F)SC4=C2CCN(C4)C