AC1MOCW6
5-(4-bromophenyl)sulfonyl-6-imino-11-methyl-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 3-[(4-bromophenyl)sulfonyl]-2-imino-10-methyl-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one|3-((4-bromophenyl)sulfonyl)-2-imino-10-methyl-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one
CAS: 877809-10-4
| Molecular Formula | C23H23BrN4O3S |
|---|---|
| Molecular Weight | 514.06744 g/mol |
| LogP | 4.22259 |
| Topological Polar Surface Area | 97.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.06744 |
| Monoisotopic Mass | 514.06744 |
| Heavy Atoms | 32 |
| Complexity | 1555.2642 |
Chemical Identifiers
| CAS Number | 877809-10-4 |
|---|---|
| SMILES | CCCCCN1C2=C(C=C(C1=N)S(=O)(=O)C3=CC=C(C=C3)Br)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
AC1MOCW6 (CAS 877809-10-4), with molecular formula C23H23BrN4O3S and molecular weight 514.06744 g/mol. IUPAC: 5-(4-bromophenyl)sulfonyl-6-imino-11-methyl-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-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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