Completing data — usually done within a minute
Basic information
- CAS
123040-16-4- Standard SMILES
CN1C(=O)COc2c(C(=O)NC3CN4CCC3CC4)cc(Cl)cc21.Cl- InChIKey
DBMKBKPJYAHLQP-UHFFFAOYSA-N- Molecular formula
- C17H21Cl2N3O3
- Average molar mass
- 386.3 g/mol
Overview
Azasetron hydrochloride is a benzoxazine.
Names & identifiers
- Preferred name
- Y 25130
- IUPAC
- N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxamide;hydrochloride
Names & synonyms
azasetron hydrochloride123040-16-4Azasetron HClSerotone2BSS7XL60SY 25130RefChem:934383692-159-3N-(1-Azabicyclo(2.2.2)oct-3-yl)-6-chloro-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-8-carboxamide hydrochloride141922-90-9D-erythro-Sphingosine (Brain, Porcine)477243-03-1
Show more names
(+)-Azasetron hydrochloride123040-94-8123040-96-0AZASETRONHYDROCHLORIDEMFCD00209913Azasetron hydrochloride [JAN]123040-93-7Azasetron (hydrochloride)
Database identifiers
- CAS
123040-16-4- PubChem CID
- 115000
- DTXSID
DTXSID00924358- ChEMBL
CHEMBL4303332- ChEBI
CHEBI:31246- UNII
- 2BSS7XL60S
- EC Number
- 692-159-3
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 523
Safety & regulation
GHS classification
GHS Classification
Warning
H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesRepr. 2 (100%)
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs used to prevent NAUSEA or VOMITING.
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS.
Suppliers100 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
浙江海洲制药有限公司0576-88221739 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
United Life Science020-82099279 18988941402 · [email protected]
Related reactions
1 records
Compound notes
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