Molecule ID: 6842

IUPAC Name: 10-methylacridin-10-ium-3,6-diamine;chloride

Description: The molecule is the 10-methochloride salt of 3,6-diaminoacridine. Note that a mixture of this compound with 3,6-diaminoacridine (proflavine) is known as acriflavine or neutral acriflavine. It has a role as an antibacterial agent, an antiseptic drug, a carcinogenic agent, an intercalator and a histological dye. It contains a 3,6-diamino-10-methylacridinium.

SMILES: C[n+]1c2cc(N)ccc2cc2ccc(N)cc21.[Cl-]

SELFIES: [C][N+1][=C][C][=C][Branch1][C][N][C][=C][C][Ring1][#Branch1][=C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][Ring1][S].[Cl-1]

InChI: InChI=1S/C14H13N3.ClH/c1-17-13-7-11(15)4-2-9(13)6-10-3-5-12(16)8-14(10)17;/h2-8H,1H3,(H3,15,16);1H

Molecular Properties:
- Polar Surface Area: 55.9 Ų
- LogP: nan