| CAS Number | 1609452-30-3 |
| Catalog Number | AG01EOQ6(AGN-PC-3H46HC) |
| Chemical Name | 7,8-Dibromo-5,6-dihydro-9-methyl-2-(1-piperazinyl)-4H-imidazo[4,5,1-ij]quinoline hydrochloride |
| IUPAC Name | 6,7-dibromo-5-methyl-2-piperazin-1-yl-1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene;hydrochloride |
| 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 |
| InChI Key | GQXLWUCQESKBSC-UHFFFAOYSA-N |
| MDL Number | MFCD31692363 |
| Molecular Formula | C15H19Br2ClN4 |
| Molecular Weight | 450.5992 |
| SMILES | CC3=C2C1=C(C(Br)=C3Br)CCCN1C(N4CCNCC4)=N2.[H]Cl |
| UNII | SDM3M518PJ |
| Synonyms | SEL120-34A (monohydrochloride),
1609452-30-3,
1609522-33-9,
UNII-SDM3M518PJ,
SDM3M518PJ,
SEL120-34A hydrochloride,
SEL120-34A HCl,
SCHEMBL17106021,
SEL12034A,
SEL 12034A,
SEL-12034A,
SEL 120-34A,
SEL-120-34A,
HY-111388A,
CS-0041061,
A17086,
7,8-Dibromo-9-methyl-2-piperazin-1-yl-5,6-dihydro-4H-imidazo[4,5,1-ij]quinoline Hydrochloride,
|
| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 449.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 450.603g/mol |
| Monoisotopic Mass | 447.966g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number