C27H21N3O4
methyl 2-[(10S,15S)-12,14-dioxo-10-phenyl-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl]benzoate
Also Known As: methyl 2-((5S,11aS)-1,3-dioxo-5-phenyl-11,11a-dihydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H,5H,6H)-yl)benzoate
CAS: 956439-75-1
| Molecular Formula | C27H21N3O4 |
|---|---|
| Molecular Weight | 451.1532 g/mol |
| LogP | 4.4374 |
| Topological Polar Surface Area | 82.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 451.1532 |
| Monoisotopic Mass | 451.1532 |
| Heavy Atoms | 34 |
| Complexity | 1459.2789 |
Chemical Identifiers
| CAS Number | 956439-75-1 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1N2C(=O)[C@@H]3CC4=C([C@@H](N3C2=O)C5=CC=CC=C5)NC6=CC=CC=C46 |
Product Overview
C27H21N3O4 (CAS 956439-75-1), with molecular formula C27H21N3O4 and molecular weight 451.1532 g/mol. IUPAC: methyl 2-[(10S,15S)-12,14-dioxo-10-phenyl-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl]benzoate.
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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