Vitas-M small molecule compound

4-[(E)-{2-[(4-benzylpiperazin-1-yl)acetyl]hydrazinylidene}methyl]benzoic acid

Catalog ID
STL333797
SMILES O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C/c1ccc(cc1)C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H24N4O3 MW 380.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3/c26-20(23-22-14-17-6-8-19(9-7-17)21(27)28)16-25-12-10-24(11-13-25)15-18-4-2-1-3-5-18/h1-9,14H,10-13,15-16H2,(H,23,26)(H,27,28)/b22-14+
InChIKey
ATFLCMQJPPPAIM-HYARGMPZSA-N
Synonyms

(E)4((2(2(4benzylpiperazin1yl)acetyl)hydrazono)methyl)benzoicacid
4((2(2(4BENZYLPIPERAZIN1YL)ACETYL)HYDRAZONO)METHYL)BENZOICACID
4((E)((2(4benzylpiperazin1ium1yl)acetyl)hydrazinylidene)methyl)benzoate
4((E)((2(4BENZYLPIPERAZIN1YL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOICACID
4((E)(2((4benzylpiperazin1yl)acetyl)hydrazinylidene)methyl)benzoicacid
C1CN(CC(NH+)1CC(=O)NN=CC2=CC=C(C=C2)C(=O)(O))CC3=CC=CC=C3
InChI=1SC21H24N4O3c2620(232214176819(9717)21(27)28)1625121024(111325)15184213518h1914H10131516H2(H2326)(H2728)b2214+
MFCD02675526
O=C(CN1CCN(CC1)Cc1ccccc1)NN=Cc1ccc(cc1)C(=O)O
ZINC000022931263
ZINC31830151

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.