Basic information
- CAS
17692-22-7- Standard SMILES
Cc1sc2ccccc2c1CC1=NCCN1- InChIKey
NDNKHWUXXOFHTD-UHFFFAOYSA-N- Molecular formula
- C13H14N2S
- Average molar mass
- 230.33 g/mol
- Monoisotopic mass
- 230.08776963
Overview
Metizoline is a member of 1-benzothiophenes.
Names & identifiers
- Preferred name
- Metizoline
- IUPAC
- 2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole
- English name
- Benazolin
- Molecular formula
- C13H14N2S
- Molecular weight
- 230.33
Names & synonyms
METIZOLINEMetyzoline17692-22-7MetizolinaMetizolinum2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazoleZ27L8N105UDTXSID90749832-(2-methylbenzo(b)thien-3-ylmethyl)-2-imidazoline1H-Imidazole, 4,5-dihydro-2-((2-methylbenzo(b)thien-3-yl)methyl)-1H-Imidazole, 4,5-dihydro-2-[(2-methylbenzo[b]thien-3-yl)methyl]-2-((2-methyl-1-benzothiophen-3-yl)methyl)-4,5-dihydro-1H-imidazole
Show more names
Galtak[R]Mekizolinum2-[(2-Methylbenzo[b]thiophen-3-yl)methyl]-2-imidazoline
RefChem:158365DTXCID8035631R01AA10Benazoline oxalate2-((2-Methylbenzo[b]thiophen-3-yl)methyl)-4,5-dihydro-1H-imidazoleMetizoline [INN:BAN]Metizolinum [INN-Latin]Metizolina [INN-Spanish]
Database identifiers
- CAS
17692-22-7- PubChem CID
- 28688
- DTXSID
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 290
Physicochemical properties
- Melting point
- 156 · 156-157°
- FDA UNII
- 27 L8N105U · Z27L8N105U
- ATC code
- 1 AA10 · R01AA10
- EPA Substance Registry System
- 1 H-Imidazole, · 1H-Imidazole, 4,5-dihydro-2-[(2-methylbenzo[b]thien-3-yl)methyl]- (17692-22-7)
Chemistry & industry
Pharmacology
ATC Code
R - Respiratory system
QR - Respiratory system
Applications
UsesAdrenergic (vasoconstrictor).
Suppliers4 total
2A PharmaChem USA[email protected]
Leancare Ltd.[email protected]
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
3B Scientific Corporation[email protected]
Additional notes
DefinitionChEBI: Metizoline is a member of 1-benzothiophenes.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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