AC1LWJHK
12,12-dimethyl-4-phenyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: BAS 02376234|AK-968/37171112|2-(allylsulfanyl)-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|12,12-Dimethyl-4-phenyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one|6,6-dimethyl-3-phenyl-2-prop-2-enylsulfanyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one|2-(allylthio)-6,6-dimethyl-3-phenyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one|6,6-dimethyl-3-phenyl-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C20H20N2O2S2 |
|---|---|
| Molecular Weight | 384.09662 g/mol |
| LogP | 4.5766 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.09662 |
| Monoisotopic Mass | 384.09662 |
| Heavy Atoms | 26 |
| Complexity | 1035.3861 |
Chemical Identifiers
| CAS Number | 351007-43-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC=C)C4=CC=CC=C4)C |
Product Overview
AC1LWJHK (CAS 351007-43-7), with molecular formula C20H20N2O2S2 and molecular weight 384.09662 g/mol. IUPAC: 12,12-dimethyl-4-phenyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.