Grundinformationen
- Standard-SMILES
Cl.Cl.O=c1[nH]c2ncccc2n1C1CCNCC1- InChIKey
OHUCGNJZMRINKX-UHFFFAOYSA-N- Summenformel
- C11H16Cl2N4O
- Durchschnittliche Molmasse
- 291,17 g/mol
- Monoisotopische Masse
- 290,07011649
Überblick
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Namen und Bezeichner
- Bevorzugter Name
- 1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride
- IUPAC
- 1-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride
Namen und Synonyme
1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride1-piperidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one dihydrochloride1-(piperidin-4-yl)-1H,2H,3H-imidazo(4,5-b)pyridin-2-one dihydrochloride1-Piperidin-4-yl-1,3-dihydroimidazo(4,5-b)pyridin-2-one dihydrochlorideRefChem:428316937-843-7781649-84-11-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one dihydrochloride1-piperidin-4-yl-1,3-dihydro-imidazo[4,5-b]pyridin-2-one dihydrochlorideMFCD147051731-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride2-Oxo-1-(4-piperidinyl)-2,3-dihydro-1H-imidazo[4,5-b]pyridine dihydrochloride
Weitere Namen anzeigen
1-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one (Hydrochloride)OHUCGNJZMRINKX-UHFFFAOYSA-N1,3-Dihydro-1-(4-piperidinyl)-2H-imidazo[4,5-b]pyridin-2-one DihydrochlorideRimegepant Impurity 2 DiHClSCHEMBL438908orb3143748CHEMBL3498426SCHEMBL30007314
Datenbank-Bezeichner
- CAS
781649-84-1- PubChem CID
- 22293181
- DTXSID
DTXSID80624480- ChEMBL
CHEMBL3498426- EC Number
- 937-843-7
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 57,3 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 277
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Zugehörige Reaktionen
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