Account di-tert-Butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) 4-nitrobenzoate
- Catalog No. :
- ACEBDI235
- CAS No. :
- 1585969-26-1
- Molecular Formula :
- C59H59N9O13
- Molecular Weight :
- 1102.17
IUPAC Name:di-tert-butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) bis(4-nitrobenzoate)
![di-tert-Butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) 4-nitrobenzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | di-tert-Butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) 4-nitrobenzoate |
|---|---|
| IUPAC Name | di-tert-butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) bis(4-nitrobenzoate) |
| MDL No. | MFCD29924771 |
| Molecular Formula | C59H59N9O13 |
| Molecular Weight | 1102.17 |
| SMILES | CC(C)(C)OC(N(CCC1)[C@@H]1C2=NC=C(N2)C(C=C3)=CC4=C3C5=CC6=C(N5[C@H](C7=CC=CC=C7)O4)C=CC(C8=CN=C([C@H]9N(C(OC(C)(C)C)=O)CCC9)N8)=C6)=O.O=C(O)C%10=CC=C([N+]([O-])=O)C=C%10.O=C(O)C%11=CC=C([N+]([O-])=O)C=C%11 |
| InChI Key | IIZHPYRZKNFJSX-XAMNAXDHSA-N |
| Synonym | 1-Pyrrolidinecarboxylic acid, 2,2'-[[(6S)-6-phenyl-6H-indolo[1,2-c][1,3]benzoxazine-3,10-diyl]di-1H-imidazole-5,2-diyl]bis-, 1,1'-bis(1,1-dimethylethyl) ester, (2S,2'S)-, 4-nitrobenzoate;di-tert-Butyl 2,2'-(((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))(2S,2'S)-bis(pyrrolidine-1-carboxylate) 4-nitrobenzoate |
| CAS No. | 1585969-26-1 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACEBDI235 Molecular Building Block Synthetic Route
Dimethyl ((2S,2'S)-((2S,2'S)-2,2'-(5,5'-((S)-6-phenyl-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methyl-1-oxobutane-2,1-diyl))dicarbamate
(S)-6-Phenyl-3,10-bis(2-((S)-pyrrolidin-2-yl)-1H-imidazol-5-yl)-6H-benzo[5,6][1,3]oxazino[3,4-a]indole dihydrochloride
Dimethyl ((2S,2'S)-((2S,2'S)-(((S)-6-(chroman-7-yl)-1-fluoro-6H-benzo[5,6][1,3]oxazino[3,4-a]indole-3,10-diyl)bis(1H-imidazole-5,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methyl-1-oxobutane-1,2-diyl))dicarbamate