AC1M0F9N
3-[(4-chlorophenyl)methylsulfanyl]-7-ethyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: 1-((4-chlorobenzyl)thio)-4-ethyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one|1-[(4-chlorobenzyl)sulfanyl]-4-ethyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
CAS: 579446-32-5
| Molecular Formula | C20H19ClN4OS2 |
|---|---|
| Molecular Weight | 430.06888 g/mol |
| LogP | 4.9501 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.06888 |
| Monoisotopic Mass | 430.06888 |
| Heavy Atoms | 28 |
| Complexity | 1239.5336 |
Chemical Identifiers
| CAS Number | 579446-32-5 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=C(C=C4)Cl)SC5=C2CCCC5 |
Product Overview
AC1M0F9N (CAS 579446-32-5), with molecular formula C20H19ClN4OS2 and molecular weight 430.06888 g/mol. IUPAC: 3-[(4-chlorophenyl)methylsulfanyl]-7-ethyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-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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