AC1LIBCK
13-amino-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),14-pentaen-12-one
Also Known As: Oprea1_695215|8-amino-4-isobutyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7(8H)-one|8-amino-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7(8H)-one
CAS: 799809-04-4
| Molecular Formula | C16H18N4OS |
|---|---|
| Molecular Weight | 314.12012 g/mol |
| LogP | 2.4072 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.12012 |
| Monoisotopic Mass | 314.12012 |
| Heavy Atoms | 22 |
| Complexity | 954.3198 |
Chemical Identifiers
| CAS Number | 799809-04-4 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=O)N(C=N4)N |
Product Overview
AC1LIBCK (CAS 799809-04-4), with molecular formula C16H18N4OS and molecular weight 314.12012 g/mol. IUPAC: 13-amino-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),14-pentaen-12-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.
View MSDS →
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