AC1L428A
(10S,13S)-13-(hexoxymethyl)-9-methyl-10-propan-2-yl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4(15),5,7-tetraen-11-one
Also Known As: N-Glycylglycyl-S-acetylcysteamine trifluoroacetate|3H-Pyrrolo(4,3,2-gh)-1,4-benzodiazonin-3-one, 5-((hexyloxy)methyl)-1,2,4,5,6,8-hexahydro-1-methyl-2-(1-methylethyl)-, (2S-(2R*,5R*))-|(2S,5S)-5-[(Hexyloxy)methyl]-1-methyl-2-(propan-2-yl)-2,5,6,8-tetrahydro-1H-[1,4]diazonino[7,6,5-cd]indol-3-ol|5-[(Hexyloxy)methyl]-1-methyl-2-(propan-2-yl)-2,5,6,8-tetrahydro-1H-[1,4]diazonino[7,6,5-cd]indol-3-ol
| Molecular Formula | C23H35N3O2 |
|---|---|
| Molecular Weight | 385.27292 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 385.27292 |
| Monoisotopic Mass | 385.27292 |
| Heavy Atoms | 28 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 97306-43-9 |
|---|---|
| SMILES | CCCCCCOC[C@@H]1CC2=CNC3=C2C(=CC=C3)N([C@H](C(=O)N1)C(C)C)C |
| InChIKey | YVQPFXSKFFVKNQ-AVRDEDQJSA-N |
Product Overview
AC1L428A (CAS 97306-43-9), with molecular formula C23H35N3O2 and molecular weight 385.27292 g/mol. IUPAC: (10S,13S)-13-(hexoxymethyl)-9-methyl-10-propan-2-yl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4(15),5,7-tetraen-11-one.
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