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1H-3-benzazepin-7-ol, 8-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-

HCID 1243
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
99295-33-7
Standard SMILES
CN1CCc2cc(Br)c(O)cc2C(c2ccccc2)C1
InChIKey
XFTVOHWWEQGXLS-UHFFFAOYSA-N
Molecular formula
C17H18BrNO
Average molar mass
332.2 g/mol
Monoisotopic mass
331.05718

Overview

8-bromo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol is a benzazepine.

Names & identifiers

Preferred name
1H-3-benzazepin-7-ol, 8-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-
IUPAC
8-bromo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol
English name
8-Bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-1H-3-benzazepin-7-ol hydrobromide
Molecular formula
C17H18BrNO
Molecular weight
332.23

Names & synonyms

1H-3-Benzazepin-7-ol, 8-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-7-Bromo-8-hydroxy-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepineRefChem:9083268-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-1H-3-benzazepin-7-ol hydrobromide99295-33-7SKF-835668-Bromo-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-olSK&F-83566Skf 835668-bromo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-olD203LR7XUSSK-83566
Show more names
159021SKF 83566 hydrobromiSKF 83566 HYDROBROMIDESKF-83566, 10 mM in DMSOnicotine craving|||dorsal striatum|||Inhibitor(+/-)-SKF-83566 HYDROCHLORIDE SELECTIVE DOPAMINE D17-bromo-3-methyl-1-phenyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol hydrobromide
CHEMBL3240177-bromo-3-methyl-1-phenyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol8-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-1h-3-benzazepin-7-ol1H-3-Benzazepin-7-ol, 8-bromo-2,3,4,5-tetrahydro-3-methyl-5-phenyl-, (+/-)-SKF-83556UNII-D203LR7XUS8-Bromo-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-7-olBiomol-NT_000061

Properties

Computed structural properties

XLogP
4
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
20
Formal charge
0
Complexity
318

Physicochemical properties

storage temp.
Desiccate at RT
solubility
45 % · 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: ≥14 mg/mL
form
solid
color
light tan
EWG's Food Scores
1 · 1
FDA UNII
203 LR7XUS · D203LR7XUS
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 2 items

Compounds that bind to and inhibit the action of ADENYLYL CYCLASES.

Drugs that bind to but do not activate DOPAMINE RECEPTORS, thereby blocking the actions of dopamine or exogenous agonists. Many drugs used in the treatment of psychotic disorders (ANTIPSYCHOTIC AGENTS) are dopamine antagonists, although their therapeutic effects may be due to long-term adjustments of the brain rather than to the acute effects of blocking dopamine receptors. Dopamine antagonists have been used for several other clinical purposes including as ANTIEMETICS, in the treatment of Tourette syndrome, and for hiccup. Dopamine receptor blockade is associated with NEUROLEPTIC MALIGNANT SYNDROME.

Applications

UsesSKF 83566 Hydrobromide is a very potent and selective D1-like dopamine receptor antagonist, specifically at the 5-HT2 receptor.

Suppliers23 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
云南苏理生物医药科技有限公司0871-68355600 18787766125 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
无锡捷化医药科技有限公司83588313 18800520310 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
99295-33-7
PubChem CID
1243
DTXSID
DTXSID8043816
ChEMBL
CHEMBL324017
ChEBI
CHEBI:91747
UNII
D203LR7XUS
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
开封明仁药业有限公司0371-65741762 · [email protected]
风咏生物(AbMole)021-10000000 13000000000 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
长春礼第康达生物科技有限公司17519969391 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
河南奥诗曼生物科技有限公司13761588971 17719817155 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
上海陌孚医药科技有限公司4000862158 18117107507 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
常州辰鸿生物科技有限公司+86-0519-85788828 +86-13775037613 · [email protected]
广州优南科技有限公司020-82000279 18988941452 · [email protected]

Additional notes

DefinitionChEBI: 8-bromo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol is a benzazepine.