CID 56840792
AlkaPlorer ID: AK325132
Synonym: None
IUPAC Name: (1R,9S)-13-methyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Structure
SMILES: CC1[C@H]2CNC[C@@H]1C1=CC=CC(=O)N1C2
InChI: InChI=1S/C12H16N2O/c1-8-9-5-13-6-10(8)11-3-2-4-12(15)14(11)7-9/h2-4,8-10,13H,5-7H2,1H3/t8?,9-,10-/m0/s1
InChIKey: RGKIXECTVPHJLM-AGROOBSYSA-N
Reference
NPASS: NPC57020
Source
Properties Information
Molecule Weight: 204.273
TPSA？: 34.03
MolLogP？: 0.8009999999999997
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 3
Activities Information
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