Darodipine
Grundinformationen
- CAS
72803-02-2- Standard-SMILES
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1cccc2nonc12- InChIKey
QERUYFVNIOLCHV-UHFFFAOYSA-N- Summenformel
- C19H21N3O5
- Durchschnittliche Molmasse
- 371,4 g/mol
- Monoisotopische Masse
- 371,14812078
Namen und Bezeichner
- Bevorzugter Name
- Darodipine
- IUPAC
- diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
- Englischer Name
- Darodipine
- Summenformel
- C19H21N3O5
- Molmasse
- 371.39
Namen und Synonyme
DARODIPINE72803-02-2DarodipinoDarodipinumPY 108-068PY-108-068N4AL7X96GLDTXSID902231253,5-Pyridinedicarboxylic acid, 4-(4-benzofurazanyl)-1,4-dihydro-2,6-dimethyl-, diethyl esterRefChem:585194DTXCID901456163,5-diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Weitere Namen anzeigen
PY-108063Darodipine(PY-108068)Darodipine, 10 mM in DMSOdiethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylateDiethyl 4-(2,1,3-benzoxadiazol-7-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylatePY108068,Ca channels,PY 108068,Calcium Channel,Darodipine,Ca2+ channels,Inhibitor,inhibit
diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylatePY-108068Diethyl 4-(4-benzofurazanyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylateDazodipindiethyl 4-(benzo[c][1,2,5]oxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylatePY 108-068;PY-108068Darodipinum [Latin]Darodipino [Spanish]
Datenbank-Bezeichner
- CAS
72803-02-2- PubChem CID
- 51701
- DTXSID
DTXSID90223125- ChEMBL
CHEMBL2104154- UNII
- N4AL7X96GL
- Nikkaji
- J22.967I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,2
- Polarare Oberfläche (TPSA)
- 104 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 632
Physikochemische Eigenschaften
- Schmelzpunkt
- 148 · 148-151°C
- storage temp.
- Refrigerator
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Pale Yellow to Light Yellow
- InChI
- InChI=1S/C19H21N3O5/c1-5-25-18(23)14-10(3)20-11(4)15(19(24)26-6-2)16(14)12-8-7-9-13-17(12)22-27-21-13/h7-9,16,20H,5-6H2,1-4H3
- InChIKey
- QERUYFVNIOLCHV-UHFFFAOYSA-N
- SMILES
- C1(C)NC(C)=C(C(OCC)=O)C(C2C3C(C=CC=2)=NON=3)C=1C(OCC)=O
Sicherheit und Regulatorisches
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationA class of drugs that act by selective inhibition of calcium influx through cellular membranes.
Anwendungen
VerwendenDarodipine is a calcium channel antagonist.
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