AC1LYQ0C
4-butyl-5-ethylsulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Also Known As: Oprea1_538482|3-butyl-2-(ethylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one|3-butyl-2-(ethylthio)-6,7,8,9-tetrahydro-3H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one
CAS: 373615-75-9
| Molecular Formula | C17H24N2OS2 |
|---|---|
| Molecular Weight | 336.133 g/mol |
| LogP | 4.639 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.133 |
| Monoisotopic Mass | 336.133 |
| Heavy Atoms | 22 |
| Complexity | 717.49774 |
Chemical Identifiers
| CAS Number | 373615-75-9 |
|---|---|
| SMILES | CCCCN1C(=O)C2=C(N=C1SCC)SC3=C2CCCCC3 |
Product Overview
AC1LYQ0C (CAS 373615-75-9), with molecular formula C17H24N2OS2 and molecular weight 336.133 g/mol. IUPAC: 4-butyl-5-ethylsulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-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.
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