Acriflavine hydrochlorideProduct ingredient for Acriflavine
- Name
- Acriflavine hydrochloride
- Drug Entry
- Acriflavine
- Accession Number
- DBSALT003148
- Structure
Structure for Acriflavine hydrochloride (DBSALT003148)
- Synonyms
- Acriflavine dihydrochloride
- UNII
- 1S73VW819C
- CAS Number
- 69235-50-3
- Weight
- Average: 541.91
Monoisotopic: 540.136278 - Chemical Formula
- C27H27Cl3N6
- InChI Key
- MKLTXAHQKDVBLY-UHFFFAOYSA-N
- InChI
- InChI=1S/C14H13N3.C13H11N3.3ClH/c1-17-13-7-11(15)4-2-9(13)6-10-3-5-12(16)8-14(10)17;14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10;;;/h2-8H,1H3,(H3,15,16);1-7H,14-15H2;3*1H
- IUPAC Name
- 3,6-diamino-10-methylacridin-10-ium acridine-3,6-diamine dihydrochloride chloride
- SMILES
- Cl.Cl.[Cl-].NC1=CC2=NC3=CC(N)=CC=C3C=C2C=C1.C[N+]1=C2C=C(N)C=CC2=CC2=CC=C(N)C=C12
- External Links
- ChemSpider
- 82674
- Predicted Properties
Property Value Source logP -2.8 Chemaxon pKa (Strongest Basic) 2.35 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 55.92 Å2 Chemaxon Rotatable Bond Count 0 Chemaxon Refractivity 72.11 m3·mol-1 Chemaxon Polarizability 25.44 Å3 Chemaxon Number of Rings 6 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon