Basic information
- CAS
1216574-52-5- Standard SMILES
CCOC(=O)c1ncc2[nH]c3ccc(OCc4ccccc4)cc3c2c1COC.Cl- InChIKey
KHMDBPAODAAMBQ-UHFFFAOYSA-N- Molecular formula
- C23H23ClN2O4
- Average molar mass
- 426.9 g/mol
- Monoisotopic mass
- 426.1346349
Overview
ZK 93423 hydrochloride is an organic molecular entity.
Names & identifiers
- Preferred name
- ZK 93423 hydrochloride
- IUPAC
- ethyl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride
- English name
- ZK 93423 hydrochloride
- Molecular formula
- C23H23ClN2O4
- Molecular weight
- 426.9
Names & synonyms
ZK 93423 hydrochloride1216574-52-5ZK93423 hydrochlorideA84JFN7GNHZK-93423 hydrochlorideUNII-A84JFN7GNH4-(METHOXYMETHYL)-6-(PHENYLMETHOXY)-9H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLIC ACID ETHYL ESTER HYDROCHLORIDEethyl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate;hydrochlorideEthyl 6-(benzyloxy)-4-(methoxymethyl)-9H-pyrido(3,4-b)indole-3-carboxylate hydrochloride9H-Pyrido(3,4-b)indole-3-carboxylic acid, 4-(methoxymethyl)-6-(phenylmethoxy)-, ethyl ester, hydrochloride (1:1)4-(Methoxymethyl)-6-(phenylmethoxy)-9H-pyrido(3,4-b)indole-3-carboxylicacidethylesterhydrochlorideethyl 6-(benzyloxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate hydrochloride
Show more names
9H-Pyrido[3,4-b]indole-3-carboxylic acid, 4-(methoxymethyl)-6-(phenylmethoxy)-, ethyl ester, hydrochloride (1:1)4-(Methoxymethyl)-6-(phenylmethoxy)-9H-pyrido[3,4-b]indole-3-carboxylicacidethylesterhydrochlorideZK 93423 HClSCHEMBL19695338SCHEMBL30416830CHEBI:231362RYB57452AKOS024456898
Properties
Computed structural properties
- Topological polar surface area
- 73.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 539
Physicochemical properties
- storage temp.
- Desiccate at RT
- solubility
- 11.71 mg/ml · insoluble in ethanol; <11.71mg/ml in DMSO
- form
- solid
- color
- Yellow
- FDA UNII
- 84 JFN7GNH · A84JFN7GNH
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesZK 93423 Hydrochloride, is a potent benzodiazepine receptor agonist (IC50 = 1 nM).
Suppliers4 total
Aladdin Scientific[email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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