AC1LYZ33

3-[(4-chlorophenyl)methylsulfanyl]-7-cyclohexyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

Also Known As: 1-((4-chlorobenzyl)thio)-4-cyclohexyl-7,7-dimethyl-6,7-dihydro-4H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(9H)-one|1-[(4-chlorobenzyl)sulfanyl]-4-cyclohexyl-7,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

Molecular Formula	C25H27ClN4O2S2
Molecular Weight	514.1264 g/mol
LogP	6.4079
Topological Polar Surface Area	61.42 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	514.1264
Monoisotopic Mass	514.1264
Heavy Atoms	34
Complexity	1431.6595

Chemical Identifiers

CAS Number	840471-91-2
SMILES	CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=C(C=C5)Cl)C6CCCCC6)C