AC1LZF6A
4-benzyl-5-butylsulfanyl-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 3-benzyl-2-(butylsulfanyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one|3-benzyl-2-(butylthio)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
CAS: 351341-95-2
| Molecular Formula | C21H25N3OS2 |
|---|---|
| Molecular Weight | 399.1439 g/mol |
| LogP | 4.3864 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.1439 |
| Monoisotopic Mass | 399.1439 |
| Heavy Atoms | 27 |
| Complexity | 994.06964 |
Chemical Identifiers
| CAS Number | 351341-95-2 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=C(S2)CN(CC3)C)C(=O)N1CC4=CC=CC=C4 |
Product Overview
AC1LZF6A (CAS 351341-95-2), with molecular formula C21H25N3OS2 and molecular weight 399.1439 g/mol. IUPAC: 4-benzyl-5-butylsulfanyl-11-methyl-8-thia-4,6,11-triazatricyclo[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.
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