3-allyl-2-(propylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
AlkaPlorer ID: AK587598
Synonym: None
IUPAC Name: 3-prop-2-enyl-2-propylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Structure
SMILES: C=CCN1C(SCCC)=NC2=C(C1=O)C1(CCCCC1)CC1=CC=CC=C12
InChI: InChI=1S/C23H28N2OS/c1-3-14-25-21(26)19-20(24-22(25)27-15-4-2)18-11-7-6-10-17(18)16-23(19)12-8-5-9-13-23/h3,6-7,10-11H,1,4-5,8-9,12-16H2,2H3
InChIKey: YYQOQBFPQHZAKW-UHFFFAOYSA-N
Reference
Furoquinoline alkaloids from the southern African Rutaceae Teclea natalensis
PubChem CID: 15999212
Source
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Properties Information
Molecule Weight: 380.5570000000002
TPSA？: 34.89
MolLogP？: 5.356400000000005
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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