AC1LLJ4R
4-cyclohexyl-12,12-dimethyl-5-(2-methylprop-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: SR-01000454675-1|3-cyclohexyl-6,6-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|3-cyclohexyl-6,6-dimethyl-2-((2-methylallyl)thio)-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one
| Molecular Formula | C21H28N2O2S2 |
|---|---|
| Molecular Weight | 404.1592 g/mol |
| LogP | 5.4827 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.1592 |
| Monoisotopic Mass | 404.1592 |
| Heavy Atoms | 27 |
| Complexity | 935.78516 |
Chemical Identifiers
| CAS Number | 351006-91-2 |
|---|---|
| SMILES | CC(=C)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1C4CCCCC4 |
Product Overview
AC1LLJ4R (CAS 351006-91-2), with molecular formula C21H28N2O2S2 and molecular weight 404.1592 g/mol. IUPAC: 4-cyclohexyl-12,12-dimethyl-5-(2-methylprop-2-enylsulfanyl)-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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