AC1LYVFX
4-benzyl-5-butylsulfanyl-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: 3-benzyl-2-(butylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one|3-benzyl-2-(butylthio)-6,6-dimethyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one
CAS: 369607-30-7
| Molecular Formula | C22H26N2O2S2 |
|---|---|
| Molecular Weight | 414.1436 g/mol |
| LogP | 5.2498 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.1436 |
| Monoisotopic Mass | 414.1436 |
| Heavy Atoms | 28 |
| Complexity | 1038.1117 |
Chemical Identifiers
| CAS Number | 369607-30-7 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC4=CC=CC=C4 |
Product Overview
AC1LYVFX (CAS 369607-30-7), with molecular formula C22H26N2O2S2 and molecular weight 414.1436 g/mol. IUPAC: 4-benzyl-5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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