AC1MRB3T
1-adamantyl-(5-amino-7-thia-1,9-diazatetracyclo[9.2.2.02,10.04,8]pentadeca-2(10),3,5,8-tetraen-6-yl)methanone
Also Known As: AG-205/33137001|(3r,5r,7r)-adamantan-1-yl(8-amino-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridin-7-yl)methanone|1-adamantyl[5-amino-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraen-6-yl]methanone
CAS: 339199-90-5
| Molecular Formula | C23H27N3OS |
|---|---|
| Molecular Weight | 393.18747 g/mol |
| LogP | 4.975 |
| Topological Polar Surface Area | 59.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 393.18747 |
| Monoisotopic Mass | 393.18747 |
| Heavy Atoms | 28 |
| Complexity | 981.23 |
Chemical Identifiers
| CAS Number | 339199-90-5 |
|---|---|
| SMILES | C1CN2CCC1C3=C2C=C4C(=C(SC4=N3)C(=O)C56CC7CC(C5)CC(C7)C6)N |
Product Overview
AC1MRB3T (CAS 339199-90-5), with molecular formula C23H27N3OS and molecular weight 393.18747 g/mol. IUPAC: 1-adamantyl-(5-amino-7-thia-1,9-diazatetracyclo[9.2.2.02,10.04,8]pentadeca-2(10),3,5,8-tetraen-6-yl)methanone.
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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