AC1MV39X

2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide

Also Known As: 2-((4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)thio)-N-(4-phenylbutan-2-yl)acetamide|2-[(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide

Molecular Formula	C28H32N4OS2
Molecular Weight	504.20175 g/mol
LogP	6.3004
Topological Polar Surface Area	67.77 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	504.20175
Monoisotopic Mass	504.20175
Heavy Atoms	35
Complexity	1335.551

Chemical Identifiers

CAS Number	488129-89-1
SMILES	CCCCC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC(=O)NC(C)CCC5=CC=CC=C5