Product Name: Pyridinium, 4,4'-(suberoylbis(imino-p-phenyleneimino))bis(1-ethyl-, dibromide (CAS NO.60172-05-6)
Molecular Formula: C34H42Br2N6O2
Molecular Weight: 726.5443g/mol
Mol File: 60172-05-6.mol
H-Bond Donor: 4
H-Bond Acceptor: 6
Structure Descriptors of Pyridinium, 4,4'-(suberoylbis(imino-p-phenyleneimino))bis(1-ethyl-, dibromide (CAS NO.60172-05-6):
IUPAC Name: N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]octanediamidedibromide
Canonical SMILES: CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)CC.[Br-].[Br-]
InChI: InChI=1S/C34H40N6O2.2BrH/c1-3-39-23-19-31(20-24-39)35-27-11-15-29(16-12-27)37-33(41)9-7-5-6-8-10-34(42)38-30-17-13-28(14-18-30)36-32-21-25-40(4-2)26-22-32;;/h11-26H,3-10H2,1-2H3,(H2,37,38,41,42);2*1H
InChIKey: QYQXMDCAIDQNAV-UHFFFAOYSA-N
1. | dnd-mus:lym 40 µmol/L | JMCMAR Journal of Medicinal Chemistry. 22 (1979),134. | ||
2. | ipr-mus LD10:30 mg/kg | JMCMAR Journal of Medicinal Chemistry. 22 (1979),134. |
Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and Br−.
Pyridinium, 4,4'-(suberoylbis(imino-p-phenyleneimino))bis(1-ethyl-, dibromide ,its CAS NO. is 60172-05-6,the synonyms is 4,4'-(Suberoylbis(imino-p-phenyleneimino))bis(1-ethylpyridinium) dibromide .
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