Vitas-M small molecule compound

(5-nitrobenzene-1,3-diyl)bis[(4-benzylpiperazin-1-yl)methanone]

Catalog ID
STK092677
SMILES [O-][N+](=O)c1cc(cc(c1)C(=O)N1CCN(CC1)Cc1ccccc1)C(=O)N1CCN(CC1)Cc1ccccc1

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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 C30H33N5O4 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O4/c36-29(33-15-11-31(12-16-33)22-24-7-3-1-4-8-24)26-19-27(21-28(20-26)35(38)39)30(37)34-17-13-32(14-18-34)23-25-9-5-2-6-10-25/h1-10,19-21H,11-18,22-23H2
InChIKey
FFOMDQZLQSTUOU-UHFFFAOYSA-N
Synonyms
332116-31-1
(3(4BENZYLPIPERAZINE1CARBONYL)5NITROPHENYL)(4BENZYLPIPERAZIN1YL)METHANONE
(5nitro13phenylene)bis((4benzylpiperazin1yl)methanone)
(5NITROBENZENE13DIYL)BIS((4BENZYLPIPERAZIN1YL)METHANONE)
(O)(N+)(=O)c1cc(cc(c1)C(=O)N1CCN(CC1)Cc1ccccc1)C(=O)N1CCN(CC1)Cc1ccccc1
332116311
5NITRO3((4BENZYLPIPERAZINYL)CARBONYL)PHENYL4BENZYLPIPERAZINYLKETONE
C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CC(=C3)(N+)(=O)(O))C(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC30H33N5O4c3629(33151131(121633)22247314824)261927(2128(2026)35(38)39)30(37)34171332(141834)232595261025h1101921H11182223H2
MFCD01993372
STK092677
ZINC000019372075
ZINC19372075

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Available files

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