Basic information
- CAS
23465-76-1- Standard SMILES
CCN(CC)CCn1c(=O)c(Cc2ccc(OC)cc2)nc2ccccc21- InChIKey
MSPRUJDUTKRMLM-UHFFFAOYSA-N- Molecular formula
- C22H27N3O2
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.21032711
Overview
Caroverine is a quinoxaline derivative.
Names & identifiers
- Preferred name
- Caroverine
- IUPAC
- 1-[2-(diethylamino)ethyl]-3-[(4-methoxyphenyl)methyl]quinoxalin-2-one
- English name
- CAROVERINE
- Molecular formula
- C22H27N3O2
- Molecular weight
- 365.47
Names & synonyms
Caroverine23465-76-1SpasmiumSpadonDTXSID6049010XJ73B0K6KB1-(2-(Diethylamino)ethyl)-3-(p-methoxybenzyl)-2(1H)-quinoxalinoneDTXCID7028936P 201-11-Diethylaminoethyl-3-(p-methoxybenzyl)quinoxalone-2RefChem:1237971-(2-(diethylamino)ethyl)-3-((4-methoxyphenyl)methyl)-1,2-dihydroquinoxalin-2-one
Show more names
CaroverinumCaroverinum [inn-latin]Caroverina [inn-spanish]1-[2-(Diethylamino)ethyl]-3-[(4-methoxyphenyl)methyl]quinoxalin-2(1H)-one
CaroverinCaroverinaCaroverine [INN]1-[2-(diethylamino)ethyl]-3-[(4-methoxyphenyl)methyl]quinoxalin-2-one2(1H)-Quinoxalinone, 1-[2-(diethylamino)ethyl]-3-[(4-methoxyphenyl)methyl]-Caroverine (INN)MFCD00865257NCGC00186046-01
Database identifiers
- CAS
23465-76-1- PubChem CID
- 65709
- DTXSID
DTXSID6049010- ChEMBL
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 510
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Melting point
- 69 ° · 69°
- Boiling point
- 0.01 · bp0.01 202°
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- solubility
- 100 · DMSO:100.0(Max Conc. mg/mL);248.8(Max Conc. mM)
- pka
- 9.52 · 9.52±0.25(Predicted)
- FDA UNII
- 73 B0K6KB · XJ73B0K6KB
- ATC code
- 3 AX11 · A03AX11
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Pharmacology
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
MeSH Pharmacological Classification
A class of drugs that act by selective inhibition of calcium influx through cellular membranes.
Drugs that bind to but do not activate excitatory amino acid receptors, thereby blocking the actions of agonists.
Applications
UsesCaroverine is a quinoxaline compound that was originally developed as a spasmolytic drug, but is now used to treat inner ear diseases such as tinnitus. Caroverine is a calcium channel blocker and is also an antiglutamatergic drug.
Suppliers17 total
杭州品高化工有限公司0571-87658025 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
常州平博医药研发有限公司086-0519-83990708 18915800124 · [email protected]
苏州莱惠生物技术有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…