AC1LZ0AI
ethyl 2-[(4-benzyl-11-ethyl-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: Oprea1_246054|ethyl [(3-benzyl-7-ethyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate|ethyl 2-((3-benzyl-7-ethyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
CAS: 369608-75-3
| Molecular Formula | C22H25N3O3S2 |
|---|---|
| Molecular Weight | 443.13373 g/mol |
| LogP | 3.5395 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.13373 |
| Monoisotopic Mass | 443.13373 |
| Heavy Atoms | 30 |
| Complexity | 1108.2535 |
Chemical Identifiers
| CAS Number | 369608-75-3 |
|---|---|
| SMILES | CCN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)OCC)CC4=CC=CC=C4 |
Product Overview
AC1LZ0AI (CAS 369608-75-3), with molecular formula C22H25N3O3S2 and molecular weight 443.13373 g/mol. IUPAC: ethyl 2-[(4-benzyl-11-ethyl-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.
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