AC1M03DZ

4,4-dimethyl-15-methylsulfanyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),14-pentaene-13-thione

Also Known As: 2,2-dimethyl-10-(methylsulfanyl)-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine-8-thiol|2,2-dimethyl-10-(methylthio)-5-phenyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine-8-thiol

Molecular Formula	C21H19N3OS3
Molecular Weight	425.06903 g/mol
LogP	6.14229
Topological Polar Surface Area	50.8 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	425.06903
Monoisotopic Mass	425.06903
Heavy Atoms	28
Complexity	1275.2788

Chemical Identifiers

CAS Number	577959-83-2
SMILES	CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=S)N=C(N4)SC)C5=CC=CC=C5)C