N-{2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl}-3-iodo-N-methylbenzamide
AlkaPlorer ID: AK245268
Synonym: None
IUPAC Name: N-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-iodo-N-methylbenzamide
Structure
SMILES: CN(C(=O)C1=CC=CC(I)=C1)N1C2=CC=CC=C2CCC2=CC=CC=C21
InChI: InChI=1S/C22H19IN2O/c1-24(22(26)18-9-6-10-19(23)15-18)25-20-11-4-2-7-16(20)13-14-17-8-3-5-12-21(17)25/h2-12,15H,13-14H2,1H3
InChIKey: NEDNJKMVAGWUCJ-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 454.3110000000002
TPSA？: 23.550000000000004
MolLogP？: 5.215100000000004
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 4
Activities Information
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