Vitas-M small molecule compound

N-(2-{4-[(3-fluorophenyl)carbonyl]piperazin-1-yl}ethyl)-N'-(4-methoxyphenyl)ethanediamide

Catalog ID
STK026465
SMILES COc1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)C(=O)c1cccc(c1)F

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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 C22H25FN4O4 MW 428.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN4O4/c1-31-19-7-5-18(6-8-19)25-21(29)20(28)24-9-10-26-11-13-27(14-12-26)22(30)16-3-2-4-17(23)15-16/h2-8,15H,9-14H2,1H3,(H,24,28)(H,25,29)
InChIKey
RFQWUOLBYYXRAD-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)NC(=O)C(=O)NCCN2CCN(CC2)C(=O)C3=CC(=CC=C3)F
COc1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)C(=O)c1cccc(c1)F
InChI=1SC22H25FN4O4c131197518(6819)2521(29)20(28)2491026111327(141226)22(30)1632417(23)1516h2815H914H21H3(H2428)(H2529)
MFCD00745442
N(2(4((3FLUOROPHENYL)CARBONYL)PIPERAZIN1YL)ETHYL)N(4METHOXYPHENYL)ETHANEDIAMIDE
N(2(4(3FLUOROBENZOYL)PIPERAZIN1YL)ETHYL)N(4METHOXYPHENYL)OXAMIDE
N1(2(4(3fluorobenzoyl)piperazin1yl)ethyl)N2(4methoxyphenyl)oxalamide
STK026465
ZINC000019805412
ZINC19805412

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Available files

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