1-[1-Oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
Grundinformationen
- Standard-SMILES
CC(=O)N1CCc2c(c(-c3ccc(C(F)(F)F)cc3)nn2CC2CO2)C1- InChIKey
SYEZRHZJCHIWHV-UHFFFAOYSA-N- Summenformel
- C18H18F3N3O2
- Durchschnittliche Molmasse
- 365,3 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 1-[1-Oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
- IUPAC
- 1-[1-(oxiran-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
Namen und Synonyme
1-[1-oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanoneSCHEMBL29737881 -[1 -oxiranylmethyl-3-(4-trifluoromethyl- phenyl)-1,4,6,7-tetrahyd ro-pyrazolo[4,3-c]pyrid in-5-yl]-ethanone1-[1- oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3- c]pyridin-5-yl]-ethanone1-[1-oxiranylmethyl-3-(4-trifluoromethyl -phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone1-[1-oxiranylmethyl-3-(4-trifluoromethyl- phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone1-[1-oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7- tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
Datenbank-Bezeichner
- PubChem CID
- 22293817
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,8
- Polarare Oberfläche (TPSA)
- 50,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 26
- Formalladung
- 0
- Komplexität
- 536
Zugehörige Reaktionen
43
Notizen zur Verbindung
Wird geladen…