2-(4-chlorophenyl)-5-[(3S)-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]-1,3,4-oxadiazole
AlkaPlorer ID: AK438404
Synonym: None
IUPAC Name: 2-(4-chlorophenyl)-5-[(3S)-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]-1,3,4-oxadiazole
Structure
SMILES: ClC1=CC=C(C2=NN=C([C@H]3CCN(CC4=CC=CS4)C3)O2)C=C1
InChI: InChI=1S/C17H16ClN3OS/c18-14-5-3-12(4-6-14)16-19-20-17(22-16)13-7-8-21(10-13)11-15-2-1-9-23-15/h1-6,9,13H,7-8,10-11H2/t13-/m0/s1
InChIKey: KUPROAGHAUMGLR-ZDUSSCGKSA-N
Reference
Cytotoxic Constituents of the Fruits of <i>Cananga </i><i>o</i><i>dorata</i>
PubChem CID: 51137250
Source
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Properties Information
Molecule Weight: 345.8550000000001
TPSA？: 42.16
MolLogP？: 4.441000000000003
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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