1-(4-acetylphenyl)-3-({5-ethyl-1-azabicyclo[2.2.2]octan-2-yl}methyl)urea
AlkaPlorer ID: AK130741
Synonym: None
IUPAC Name: 1-(4-acetylphenyl)-3-[[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]methyl]urea
Structure
SMILES: CC[C@H]1CN2CC[C@H]1C[C@@H]2CNC(=O)NC1=CC=C(C(C)=O)C=C1
InChI: InChI=1S/C19H27N3O2/c1-3-14-12-22-9-8-16(14)10-18(22)11-20-19(24)21-17-6-4-15(5-7-17)13(2)23/h4-7,14,16,18H,3,8-12H2,1-2H3,(H2,20,21,24)/t14-,16-,18+/m0/s1
InChIKey: KUJCDBLGXSXSFC-QILLFSRXSA-N
Reference
Marine natural products: metabolites of marine algae and herbivorous marine molluscs
PubChem CID: 11943312
Source
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Properties Information
Molecule Weight: 329.44400000000013
TPSA？: 61.440000000000005
MolLogP？: 3.131100000000001
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 4
Activities Information
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