AC1LLRNO
15-[(2-methoxyphenoxy)methyl]-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene
Also Known As: BAS 07387458|2-((2-methoxyphenoxy)methyl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine|2-[(2-methoxyphenoxy)methyl]-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
CAS: 694505-75-4
| Molecular Formula | C20H20N4O2S |
|---|---|
| Molecular Weight | 380.1307 g/mol |
| LogP | 4.1955 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.1307 |
| Monoisotopic Mass | 380.1307 |
| Heavy Atoms | 27 |
| Complexity | 1118.0217 |
Chemical Identifiers
| CAS Number | 694505-75-4 |
|---|---|
| SMILES | COC1=CC=CC=C1OCC2=NN3C=NC4=C(C3=N2)C5=C(S4)CCCCC5 |
Product Overview
AC1LLRNO (CAS 694505-75-4), with molecular formula C20H20N4O2S and molecular weight 380.1307 g/mol. IUPAC: 15-[(2-methoxyphenoxy)methyl]-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene.
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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