AC1M4ZXD

4-(4-methoxyphenyl)-12,12-dimethyl-5-(3-methylbutylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Also Known As: SR-01000454682-1|3-(4-methoxyphenyl)-6,6-dimethyl-2-[(3-methylbutyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|2-(isopentylthio)-3-(4-methoxyphenyl)-6,6-dimethyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one|3-(4-methoxyphenyl)-6,6-dimethyl-2-(3-methylbutylsulfanyl)-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one

Molecular Formula	C23H28N2O3S2
Molecular Weight	444.15414 g/mol
LogP	5.4453
Topological Polar Surface Area	53.35 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	444.15414
Monoisotopic Mass	444.15414
Heavy Atoms	30
Complexity	1114.1641

Chemical Identifiers

CAS Number	351007-07-3
SMILES	CC(C)CCSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1C4=CC=C(C=C4)OC