5,7-Diethyl-2-(2-fluoro-phenyl)-1,3-diaza-tricyclo[3.3.1.1*3,7*]decan-6-one
AlkaPlorer ID: AK343894
Synonym: None
IUPAC Name: 5,7-diethyl-2-(2-fluorophenyl)-1,3-diazatricyclo[3.3.1.13,7]decan-6-one
Structure
SMILES: CCC12CN3CC(CC)(CN(C1)C3C1=CC=CC=C1F)C2=O
InChI: InChI=1S/C18H23FN2O/c1-3-17-9-20-11-18(4-2,16(17)22)12-21(10-17)15(20)13-7-5-6-8-14(13)19/h5-8,15H,3-4,9-12H2,1-2H3
InChIKey: BJXHGMUFAVPXBZ-UHFFFAOYSA-N
Reference
Caesalpins A–H, Bioactive Cassane-Type Diterpenes from the Seeds of <i>Caesalpinia minax</i>
PubChem CID: 697671
Source
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Properties Information
Molecule Weight: 302.39300000000003
TPSA？: 23.55
MolLogP？: 2.8310000000000013
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 5
Activities Information
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