SEL-120Product ingredient for SEL120-34A free base
- Name
- SEL-120
- Drug Entry
- SEL120-34A free base
- Accession Number
- DBSALT003415
- Structure
Structure for SEL-120 (DBSALT003415)
- Synonyms
- 4H-IMIDAZO(4,5,1-IJ)QUINOLINE, 7,8-DIBROMO-5,6-DIHYDRO-9-METHYL-2-(1-PIPERAZINYL)-, HYDROCHLORIDE (1:1) / 7,8-dibromo-5,6-dihydro-9-methyl-2-(1-piperazinyl)-4H-imidazo[4,5,1-ij] quinoline hydrochloride / 7,8-DIBROMO-5,6-DIHYDRO-9-METHYL-2-(1-PIPERAZINYL)-4HIMIDAZO(4,5,1-IJ)QUINOLINE HYDROCHLORIDE
- External IDs
- SE-120-34A / SE120-34A / SEL 120 / SEL120
- UNII
- SDM3M518PJ
- CAS Number
- 1609452-30-3
- Weight
- Average: 450.6
Monoisotopic: 447.9665 - Chemical Formula
- C15H19Br2ClN4
- InChI Key
- GQXLWUCQESKBSC-UHFFFAOYSA-N
- InChI
- InChI=1S/C15H18Br2N4.ClH/c1-9-11(16)12(17)10-3-2-6-21-14(10)13(9)19-15(21)20-7-4-18-5-8-20;/h18H,2-8H2,1H3;1H
- IUPAC Name
- 6,7-dibromo-5-methyl-2-(piperazin-1-yl)-1,3-diazatricyclo[6.3.1.0^{4,12}]dodeca-2,4(12),5,7-tetraene hydrochloride
- SMILES
- Cl.CC1=C(Br)C(Br)=C2CCCN3C(=NC1=C23)N1CCNCC1
- External Links
- ChemSpider
- 71117288
- ChEMBL
- CHEMBL4578881
- Predicted Properties
Property Value Source logP 4.27 Chemaxon pKa (Strongest Basic) 8.79 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 33.09 Å2 Chemaxon Rotatable Bond Count 1 Chemaxon Refractivity 92.72 m3·mol-1 Chemaxon Polarizability 36.85 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon