1-[1-Oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone

HCID 22293817

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

Zugehörige Reaktionen

43

Notizen zur Verbindung

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