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N-(3-Guanidino-4-methylphenyl)-4-(methylpiperazine-1-yl-methyl)benzamide Dihydrochloride

N-(3-Guanidino-4-methylphenyl)-4-(methylpiperazine-1-yl-methyl)benzamide Dihydrochloride

  • CAT Number: C001112
  • CAS Number: 581076-67-7
  • Molecular Formula: C21H29ClN6O
  • Molecular Weight: 416.95
  • Purity: ≥95%
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N-(3-Guanidino-4-methylphenyl)-4-(methylpiperazine-1-yl-methyl)benzamide Dihydrochloride (Cat No.:C001112) is a complex chemical compound with a benzamide backbone. It contains a guanidino group, a methyl group, and a piperazine moiety, all attached to different positions on the benzene ring. The dihydrochloride form signifies the presence of two hydrochloride molecules. This compound may have potential applications in pharmaceutical research, possibly as a ligand or targeting agent in drug development.

Catalog Number C001112
CAS Number 581076-67-7
Synonyms

N-[3-[(Aminoiminomethyl)amino]-4-methylphenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide Dihydrochloride; Imatinib impurity N-[2-Methyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]benzoyl]amino]phenyl]guanidine Dihydrochloride;

Molecular Formula

C21H29ClN6O

Purity 95%
Solubility DMSO (Slightly), Methanol (Slightly)
Storage 4°C, Hygroscopic
IUPAC Name N-[3-(diaminomethylideneamino)-4-methylphenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide;hydrochloride
InChI InChI=1S/C21H28N6O.ClH/c1-15-3-8-18(13-19(15)25-21(22)23)24-20(28)17-6-4-16(5-7-17)14-27-11-9-26(2)10-12-27;/h3-8,13H,9-12,14H2,1-2H3,(H,24,28)(H4,22,23,25);1H
InChIKey VNYBKXFKCBBIRX-UHFFFAOYSA-N
SMILES CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)N=C(N)N.Cl

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