Hexahydrosiladifenidol

HCID 3602CAS 98299-40-2

Grundinformationen

Standard-SMILES
O[Si](CCCN1CCCCC1)(c1ccccc1)C1CCCCC1
InChIKey
QTBCATBNRIYMPB-UHFFFAOYSA-N
Summenformel
C20H33NOSi
Durchschnittliche Molmasse
331,6 g/mol
Monoisotopische Masse
331,23314121

Namen und Bezeichner

Bevorzugter Name
Hexahydrosiladifenidol
IUPAC
cyclohexyl-hydroxy-phenyl-(3-piperidin-1-ylpropyl)silane
Englischer Name
hexahydrosiladifenidol
Summenformel
C20H33NOSi
Molmasse
331.57

Namen und Synonyme

hexahydrosiladifenidolHhsi-difenidolHHSiDHexahydro-sila-diphenidol98299-40-2cyclohexyl-hydroxy-phenyl-(3-piperidin-1-ylpropyl)silaneLXZ2G00X0WSilanol, cyclohexylphenyl(3-(1-piperidinyl)propyl)-hexahydrosiladiphenidolRefChem:146060cyclohexyl(phenyl)[3-(piperidin-1-yl)propyl]silanolGNF-Pf-5565
Weitere Namen anzeigen
Hexahydro-sila-difenidol hydrochlorideCyclohexyl(3-piperidinopropyl)phenylsilanolCyclohexylphenyl(3-piperidinopropyl)silanolPhenylcyclohexyl(3-piperidinopropyl)silanolCyclohexylphenyl-(3-N-piperidinopropyl)silanolCyclohexylphenyl[3-(1-piperidinyl)propyl]silanolSilanol, 1-cyclohexyl-1-phenyl-1-[3-(1-piperidinyl)propyl]-
cyclohexyl(phenyl)(3-(piperidin-1-yl)propyl)silanolUNII-LXZ2G00X0WDTXSID20913340GTPL310CHEMBL3545990SCHEMBL21530611BDBM81799NSC_3602

Datenbank-Bezeichner

CAS
98299-40-2
PubChem CID
3602
DTXSID
DTXSID20913340
ChEMBL
CHEMBL3545990
UNII
LXZ2G00X0W
EC Number
635-538-0
Nikkaji
J128.591B

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
23,5 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
6
Schwere Atome
23

Physikochemische Eigenschaften

Siedepunkt
449.7 · 449.7±37.0 °C(Predicted)
Dichte
1.03 · 1.03±0.1 g/cm3(Predicted)
pka
13.91 · 13.91±0.20(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

risk_code
20/21/22
hazard_code
Xn
safety_code
36

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 2 Einträge

Agents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS.

Drugs that bind to but do not activate MUSCARINIC RECEPTORS, thereby blocking the actions of endogenous ACETYLCHOLINE or exogenous agonists. Muscarinic antagonists have widespread effects including actions on the iris and ciliary muscle of the eye, the heart and blood vessels, secretions of the respiratory tract, GI system, and salivary glands, GI motility, urinary bladder tone, and the central nervous system.

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