AC1LTQ8U
5,5,13-trimethyl-15-octylsulfanyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaene
Also Known As: 2,8,8-trimethyl-4-(octylsulfanyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine|2,8,8-trimethyl-4-(octylthio)-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
CAS: 672265-96-2
| Molecular Formula | C23H31N3OS2 |
|---|---|
| Molecular Weight | 429.19086 g/mol |
| LogP | 6.85182 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 429.19086 |
| Monoisotopic Mass | 429.19086 |
| Heavy Atoms | 29 |
| Complexity | 1012.43445 |
Chemical Identifiers
| CAS Number | 672265-96-2 |
|---|---|
| SMILES | CCCCCCCCSC1=NC(=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C)C |
Product Overview
AC1LTQ8U (CAS 672265-96-2), with molecular formula C23H31N3OS2 and molecular weight 429.19086 g/mol. IUPAC: 5,5,13-trimethyl-15-octylsulfanyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaene.
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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