Molecule ID: 9570252

IUPAC Name: 2-[(E)-[(1E)-1-(diaminomethylidenehydrazinylidene)propan-2-ylidene]amino]guanidine;dihydrochloride

Description: The molecule is a hydrochloride obtained by combining mitoguazone with two molar equivalents of hydrochloric acid. It has a role as an antineoplastic agent, an apoptosis inducer and an EC 4.1.1.50 (adenosylmethionine decarboxylase) inhibitor. It contains a mitoguazone(2+).

SMILES: CC(/C=N/NC(=N)N)=N\NC(=N)N.Cl.Cl

SELFIES: [C][C][Branch1][=Branch2][/C][=N][/N][C][=Branch1][C][=N][N][=N][\N][C][=Branch1][C][=N][N].[Cl].[Cl]

InChI: InChI=1S/C5H12N8.2ClH/c1-3(11-13-5(8)9)2-10-12-4(6)7;;/h2H,1H3,(H4,6,7,12)(H4,8,9,13);2*1H/b10-2+,11-3+;;

Molecular Properties:
- Polar Surface Area: 154.0 Ų
- LogP: nan