AC1LRIN1
ethyl 2-[(11-benzyl-4-cyclohexyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
Also Known As: ethyl [(7-benzyl-3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate|ethyl 2-((7-benzyl-3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
CAS: 351341-87-2
| Molecular Formula | C26H31N3O3S2 |
|---|---|
| Molecular Weight | 497.1807 g/mol |
| LogP | 5.1767 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.1807 |
| Monoisotopic Mass | 497.1807 |
| Heavy Atoms | 34 |
| Complexity | 1215.4941 |
Chemical Identifiers
| CAS Number | 351341-87-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1C5CCCCC5 |
Product Overview
AC1LRIN1 (CAS 351341-87-2), with molecular formula C26H31N3O3S2 and molecular weight 497.1807 g/mol. IUPAC: ethyl 2-[(11-benzyl-4-cyclohexyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate.
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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