AC1LJJKD
6-amino-N-(3-methylphenyl)-4-thia-2-azatricyclo[7.6.0.03,7]pentadeca-1,3(7),5,8-tetraene-5-carboxamide
Also Known As: Oprea1_521347|3-amino-N-(3-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide|AN-919/40866521|A3091/0130795|6-amino-N-(3-methylphenyl)-4-thia-2-azatricyclo[7.6.0.03,7]pentadeca-1,3(7),5,8-tetraene-5-carboxamide
CAS: 6418-29-7
| Molecular Formula | C21H23N3OS |
|---|---|
| Molecular Weight | 365.1562 g/mol |
| LogP | 5.09822 |
| Topological Polar Surface Area | 68.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.1562 |
| Monoisotopic Mass | 365.1562 |
| Heavy Atoms | 26 |
| Complexity | 976.7918 |
Chemical Identifiers
| CAS Number | 6418-29-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)C2=C(C3=C(S2)N=C4CCCCCCC4=C3)N |
Product Overview
AC1LJJKD (CAS 6418-29-7), with molecular formula C21H23N3OS and molecular weight 365.1562 g/mol. IUPAC: 6-amino-N-(3-methylphenyl)-4-thia-2-azatricyclo[7.6.0.03,7]pentadeca-1,3(7),5,8-tetraene-5-carboxamide.
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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