AC1M0LIA
2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Also Known As: 2-((5-amino-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(p-tolyl)ethanone|2-[(5-amino-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-(4-methylphenyl)ethanone
| Molecular Formula | C20H19N5OS2 |
|---|---|
| Molecular Weight | 409.1031 g/mol |
| LogP | 4.08342 |
| Topological Polar Surface Area | 86.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.1031 |
| Monoisotopic Mass | 409.1031 |
| Heavy Atoms | 28 |
| Complexity | 1209.2634 |
Chemical Identifiers
| CAS Number | 848740-08-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCCC5)N |
Product Overview
AC1M0LIA (CAS 848740-08-9), with molecular formula C20H19N5OS2 and molecular weight 409.1031 g/mol. IUPAC: 2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone.
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