ZK 93426 Hydrochloride
Basic information
- CAS
89592-45-0- Standard SMILES
CCOC(=O)c1ncc2[nH]c3cccc(OC(C)C)c3c2c1C.Cl- InChIKey
RNQJDOYVHCISJU-UHFFFAOYSA-N- Molecular formula
- C18H21ClN2O3
- Average molar mass
- 348.8 g/mol
- Monoisotopic mass
- 348.1240702
Names & identifiers
- Preferred name
- ZK 93426 Hydrochloride
- IUPAC
- ethyl 4-methyl-5-propan-2-yloxy-9H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride
- English name
- 4-Methyl-5-(1-methylethoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester hydrochloride
- Molecular formula
- C18H20N2O3
- Molecular weight
- 312.36
Names & synonyms
ZK 93426 HYDROCHLORIDE1216792-30-1ZK 93426 (hydrochloride)ethyl 4-methyl-5-propan-2-yloxy-9H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride9H-Pyrido[3,4-b]indole-3-carboxylicacid, 4-methyl-5-(1-methylethoxy)-, ethyl ester4-Methyl-5-(1-methylethoxy)-9H-pyrido[3,4-b]indole-3-carboxylicacidethylesterhydrochlorideZK-93426 Hydrochloride4-Methyl-5-(1-methylethoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester hydrochlorideorb1703891ZK 93426 HClDTXSID401028093GLXC-07187
Show more names
ZK 93426VMDUABMKBUKKPG-UHFFFAOYSA-NEthyl 5-Isopropoxy-4-methyl-?-carboline-3-carboxylate4-Methyl-5-(1-methylethoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester9H-Pyrido[3,4-b]indole-3-carboxylic acid, 4-Methyl-5-(1-Methylethoxy)-, ethyl ester
EX-A15313AKOS024456900BZ177439MS-32880HY-103499CS-0028001T23562Ethyl 5-isopropoxy-4-methyl-9H-beta-carboline-3-carboxylate hydrochloride
Database identifiers
- CAS
89592-45-0- PubChem CID
- 56972167
- DTXSID
DTXSID401028093
Properties
Computed structural properties
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 428
Physicochemical properties
- storage temp.
- Desiccate at RT
- FDA UNII
- 8 EEB2VSB3 · S8EEB2VSB3
Chemistry & industry
Applications
UsesEthyl 5-Isopropoxy-4-methyl--carboline-3-carboxylate is a member of a family of non-benzodiazepine GABAA receptor agonists.
Additional notes
DefinitionChEBI: 4-methyl-5-propan-2-yloxy-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester is a member of beta-carbolines.
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