Isometamidium bromide

3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide;bromide;hydrobromide

Also Known As: Isometamidium bromide|Isometamidium Bromide Hydrobromide|MSK8065|M & B 4180|MSK8065-100M|3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide;bromide;hydrobromide|Phenanthridinium, 8-(3-(m-amidinophenyl)-2-triazeno)-3-amino-5-ethyl-6-phenyl-, bromide, hydrobromide|Isometamidium bromide hydrobromide Solution in Methanol, 100ug/mL|3-Amino-8-[3-[3-(aminoiminomethyl)phenyl]-2-triazen-1-yl]-5-ethyl-6-phenylphenanthridinium Bromide Hydrobromide|3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide bromide hydrobromide|3-Amino-8-(3-(3-carbamimidoylphenyl)triaz-2-en-1-yl)-5-ethyl-6-phenylphenanthridin-5-ium bromide hydrobromide|3-Amino-8-[3-(3-carbamimidoylphenyl)triaz-2-en-1-yl]-5-ethyl-6-phenylphenanthridin-5-ium bromide--hydrogen bromide (1/1/1)|8-[3-(m-Amidinophenyl)-2-triazeno]-3-amino-5-ethyl-6-phenylphenanthridinium Bromide Monohydrobromide|Isometamidium Bromide Hydrobromide; Phenanthridinium, 3-amino-8-[3-[3-(aminoiminomethyl)phenyl]-2-triazen-1-yl]-5-ethyl-6-phenyl-, bromide, hydrobromide (1:1:1); Phenanthridinium, 8-[3-(m-amidinophenyl)-2-triazeno]-3-amino-5-ethyl-6-phenyl-, bromide, hydrobromide (8CI); M and B 4180

Molecular Formula	C28H27Br2N7
Molecular Weight	619.06946 g/mol
LogP	3.52637
Topological Polar Surface Area	117.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	619.06946
Monoisotopic Mass	619.06946
Heavy Atoms	37
Complexity	735.0

Chemical Identifiers

CAS Number	4174-69-0
SMILES	CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=NNC5=CC=CC(=C5)C(=N)N)N.Br.[Br-]
InChIKey	ZLKRCDXAXRAULJ-UHFFFAOYSA-N