Basic information
- CAS
172854-55-6- Standard SMILES
CN(C)CCCc1cc(C(=O)Nc2ccc(-c3ccncc3)cc2)ccc1O.Cl- InChIKey
NUDSRNNZTVHCKY-UHFFFAOYSA-N- Molecular formula
- C23H26ClN3O2
- Average molar mass
- 411.9 g/mol
- Monoisotopic mass
- 411.1713548
Overview
a 5-HT(1D) receptor antagonist; RN given refers to HCl salt
Names & identifiers
- Preferred name
- 3-(3-(Dimethylamino)propyl)-4-hydroxy-N-(4-(4-pyridinyl)phenyl)benzamide
- IUPAC
- 3-[3-(dimethylamino)propyl]-4-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide;hydrochloride
- English name
- 3-[3-(Dimethylamino)propyl]-4-hydroxy-N-[4-(4-pyridinyl)phenyl]benzamide dihydrochloride
- Molecular formula
- C23H26ClN3O2
- Molecular weight
- 411.93
Names & synonyms
172854-55-6DTXSID901694133-(3-(Dimethylamino)propyl)-4-hydroxy-N-(4-(4-pyridinyl)phenyl)benzamideBenzamide, 3-(3-(dimethylamino)propyl)-4-hydroxy-N-(4-(4-pyridinyl)phenyl)-, monohydrochlorideDTXSID701150576Benzamide, 3-[3-(dimethylamino)propyl]-4-hydroxy-N-[4-(4-pyridinyl)phenyl]-, monohydrochlorideRefChem:92285DTXCID8091904DTXCID80201159GR 55562 (hydrochloride)GR 55562 hydrochloride3-(3-(Dimethylamino)propyl)-4-hydroxy-N-(4-(pyridin-4-yl)phenyl)benzamide hydrochloride
Show more names
GR 55562GR555622HClGR55562 diHCLGR 55562 DIHYDROCHLORIDEGR 55562 dihydrochloride, 5-HT1B / 5-HT1D receptor antagonist3-[3-(Dimethylamino)-propyl]-4-hydroxy-N-[4-pyridin-4-ylphenyl]benzamide HCl3-[3-(Dimethylamino)propyl]-4-hydroxy-N-[4-(4-pyridinyl)phenyl]benzamide dihydrochloride3-(3-(DiMethylaMino)propyl)-4-hydroxy-N-(4-(pyridin-4-yl)phenyl)benzaMide dihydrochloride
Properties
Computed structural properties
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 470
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- form
- Solid
- color
- Light yellow to yellow
- Safety Statements
- 22 · 22-24/25
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
- safety_code
- 22-24/25
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationDrugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS.
Applications
UsesGR 55562 Dihydrochloride is a 5-HT1B antagonist.
Suppliers12 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
成都诺维生物科技有限公司028-81458053 · [email protected] [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
南京宁凡医药科技有限公司17368696818
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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