AC1LY5U4
5-[(4-fluorophenyl)methylsulfanyl]-7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(9),2,4,7,11(15)-pentaene
Also Known As: 3-((4-fluorobenzyl)thio)-5-(methylthio)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine|3-[(4-fluorobenzyl)sulfanyl]-5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
| Molecular Formula | C18H15FN4S3 |
|---|---|
| Molecular Weight | 402.04428 g/mol |
| LogP | 4.981 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.04428 |
| Monoisotopic Mass | 402.04428 |
| Heavy Atoms | 26 |
| Complexity | 1117.3243 |
Chemical Identifiers
| CAS Number | 799781-41-2 |
|---|---|
| SMILES | CSC1=NC2=C(C3=C(S2)CCC3)C4=NN=C(N41)SCC5=CC=C(C=C5)F |
Product Overview
AC1LY5U4 (CAS 799781-41-2), with molecular formula C18H15FN4S3 and molecular weight 402.04428 g/mol. IUPAC: 5-[(4-fluorophenyl)methylsulfanyl]-7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(9),2,4,7,11(15)-pentaene.
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