Compound: Homolka's Base
SMILES: N=C1C=CC(=C(c2ccc(N)cc2)c3ccc(N)cc3)C=C1
InChIKey: AFAIELJLZYUNPW-UHFFFAOYSA-N
Synonyms: Homolka's Base, 20N4C0M8NM, 4-((4-AMINOPHENYL)(4-IMINO-2,5-CYCLOHEXADIEN-1-YLIDENE)METHYL)BENZENAMINE, 4-((4-aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl)benzeneamine monohydrochloride, CHEBI:87663, RefChem:928586, ALPHA-(P-AMINOPHENYL)-ALPHA-(4-IMINO-2,5-CYCLOHEXADIEN-1-YLIDENE)-P-TOLUIDINE, alpha-(4-aminophenyl)-alpha-(4-imino-2,5-cyclohexadien-1-ylidene)-4-toluidine monohydrochloride, Basic Red 9, Pararosaniline, 479-73-2, 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline, MLS002701900, Parasaniline, ParaMagenta, p-Rosaniline HCl, SMR001565485, NSC10460, 4,4'-[(4-iminocyclohexa-2,5-dien-1-ylidene)methanediyl]dianiline, Benzenamine, 4-((4-aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl)-, UNII-20N4C0M8NM, Benzenamine, 4-[(4-aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl]-, pararosaniline free base, Neuro_000010, NCIStruc1_001010, NCIStruc2_000958, cid_11293, SCHEMBL825929, CHEMBL1368322, BDBM93926, CHEBI:75372, NCI10460, CCG-36728, NCGC00013110, STL257089, AKOS022135417, NCGC00013110-02, NCGC00096231-01, NCI60_000112, NS00005424, ST50826104, Q421256, 4-(4,4'-diamino-benzhydrylidene)-cyclohexa-2,5-dienone-imine, 4,4'-[(4-Iminocyclohexa-2,5-dien-1-ylidene)methylene]dianiline, 4-((4-Aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl)phenylamine, 4-[(4-aminophenyl)(4-iminocyclohexa-2,5-dienylidene)methyl]phenylamine, 4-[(4-aminophenyl)-(4-imino-1-cyclohexa-2,5-dienylidene)methyl]aniline, .ALPHA.-(P-AMINOPHENYL)-.ALPHA.-(4-IMINO-2,5-CYCLOHEXADIEN-1-YLIDENE)-P-TOLUIDINE, [4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]phenyl]amine, 4-[(4-aminophenyl)-(4-azanylidenecyclohexa-2,5-dien-1-ylidene)methyl]aniline, Benzenamine, 4-((4-aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidiene)methyl)-
Theoretical properties:
molecular_formula: C19H17N3
molecular_weight: 287.4 g/mol
exact_mass: 287.142247555 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 3
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 2
heavy_atom_count: 22
topological_polar_surface_area: 75.9 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
{"pubchem": "Pararosaniline free base is an imine that is 4-methylidenecyclohexa-2,5-dien-1-imine in which both the hydrogens of the methylidene group are replaced by 4-aminophenyl groups. The hydrochloride salt is the histological dye 'pararosaniline'. It has a role as a fluorochrome and a histological dye. It is an imine and a substituted aniline. It is a conjugate base of a pararosaniline(1+).", "chebi": "An imine that is 4-methylidenecyclohexa-2,5-dien-1-imine in which both the hydrogens of the methylidene group are replaced by 4-aminophenyl groups. The hydrochloride salt is the histological dye 'pararosaniline'.", "chembl": "PARAROSANILINE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.", "wikipedia": "Karla Leanne Homolka (born May 4, 1970), also known as Karla Leanne Teale, Leanne Teale and Leanne Bordelais, is a Canadian serial killer who acted as an accomplice to her husband, Paul Bernardo, taking active part in the rapes and murders of at least three minors in Ontario \u2013 including her own sister, Tammy Homolka \u2013 between 1990 and 1992.\nHomolka attracted worldwide media attention when a plea bargain with Ontario prosecutors meant she was only convicted of manslaughter, and served only twelve years for the torture, rapes and murders of the other victims, Leslie Mahaffy and Kristen French. Homolka testified against Bernardo, who was convicted of the Mahaffy\u2013French murders and received life imprisonment and a dangerous offender designation.\nHomolka's plea bargain came about after she told investigators that she had been Bernardo's unwilling accomplice as a result of domestic violence. However, videotapes of the crimes surfaced after the plea bargain and before Bernardo's trial which showed that Homolka had been a more active participant than she had originally claimed, including in the rape and death of her sister. As a result, the plea bargain that she had struck with prosecutors was dubbed in the Canadian press the \"Deal with the Devil\". Public outrage about the deal continued until Homolka's high-profile release from prison in 2005.\nFollowing her release, Homolka settled in Quebec, where she married a brother of her lawyer. In 2007, she settled in the Antilles and Guadeloupe, but by 2014 had returned to Quebec."}