3,4,5,6,7,8-Hexahydro-1,7-benzodiazecin-2(1H)-one
AlkaPlorer ID: AK300312
Synonym: None
IUPAC Name: 3,4,5,6,7,8-hexahydro-1H-1,7-benzodiazecin-2-one
Structure
SMILES: O=C1CCCCNCC2=CC=CC=C2N1
InChI: InChI=1S/C12H16N2O/c15-12-7-3-4-8-13-9-10-5-1-2-6-11(10)14-12/h1-2,5-6,13H,3-4,7-9H2,(H,14,15)
InChIKey: VLLXRMBAFPDJQK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Mackinlaya | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 204.27300000000005
TPSA？: 41.13
MolLogP？: 1.8986
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|