Account (1R,2R)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
- Catalog No. :
- ACMLIC596
- CAS No. :
- 857086-94-3
- Molecular Formula :
- C32H31BrN2O2
- Molecular Weight :
- 555.52
IUPAC Name:(1R,2R)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
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Product Information
| Product Name | (1R,2R)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol |
|---|---|
| IUPAC Name | (1R,2R)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol |
| MDL No. | MFCD22628788 |
| Molecular Formula | C32H31BrN2O2 |
| Molecular Weight | 555.52 |
| SMILES | O[C@@](CCN(C)C)(C1=C2C=CC=CC2=CC=C1)[C@@H](C3=CC4=CC(Br)=CC=C4N=C3OC)C5=CC=CC=C5 |
| InChI Key | QUIJNHUBAXPXFS-BHYZAODMSA-N |
| Synonym | (αR,βR)-6-Bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-3-quinolineethanol;Bedaquiline (1R,2R)Isomer Impurity 2;3-Quinolineethanol, 6-bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-, (αR,βR)-;Bedaquiline Fumarate Impurity 10;Bedaquiline (1R,2R)Isomer;Bedaquiline Impurity 30;(αR, βR)-6-Bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl- β-phenyl-3-quinolineethanol;(1R,2R)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(methylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol |
| CAS No. | 857086-94-3 |
Safety Data
- Pictogram
- Signal Word
- Gefahr
- Hazard Statement(s)
- H301-H373-H400-H410
- Precautionary Statement(s)
- P260-P264-P270-P273-P301+P310-P314-P321-P330-P391-P405-P501
Synthetic Route by SureRoute
2. ACMLIC596 Molecular Building Block Synthetic Route
(1R,2S)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
cis-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
(1S,2S)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol