AC1LO0AT
4-benzyl-5-ethylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: ChemDivAM_000234|ChemDiv1_007489|HMS608E09|AB00093440-01|AJ-292/11386135|SR-01000465237-1|3-benzyl-2-(ethylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|3-benzyl-2-ethylsulfanyl-6,6-dimethyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one|4-Benzyl-5-ethylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one|2-ethylthio-6,6-dimethyl-3-benzyl-3,5,6-trihydro-8H-pyrimidino[5',4'-4,5]thiop heno[2,3-c]pyran-4-one|3-benzyl-2-(ethylthio)-6,6-dimethyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one|4-benzyl-5-(ethylsulfanyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C20H22N2O2S2 |
|---|---|
| Molecular Weight | 386.11227 g/mol |
| LogP | 4.4696 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.11227 |
| Monoisotopic Mass | 386.11227 |
| Heavy Atoms | 26 |
| Complexity | 1006.06335 |
Chemical Identifiers
| CAS Number | 327166-79-0 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC4=CC=CC=C4 |
Product Overview
AC1LO0AT (CAS 327166-79-0), with molecular formula C20H22N2O2S2 and molecular weight 386.11227 g/mol. IUPAC: 4-benzyl-5-ethylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
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