Vitas-M small molecule compound

N-({4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}carbonyl)-L-valine

Catalog ID
STK716551
SMILES CC([C@@H](C(=O)O)NC(=O)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)C

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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 C23H27F2N3O3 MW 431.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27F2N3O3/c1-15(2)20(22(29)30)26-23(31)28-13-11-27(12-14-28)21(16-3-7-18(24)8-4-16)17-5-9-19(25)10-6-17/h3-10,15,20-21H,11-14H2,1-2H3,(H,26,31)(H,29,30)/t20-/m0/s1
InChIKey
FOWRIOVPQVITMR-FQEVSTJZSA-N
Synonyms
1014003-61-2
(2S)2((4(bis(4fluorophenyl)methyl)piperazine1carbonyl)amino)3methylbutanoicacid
(S)2(4(bis(4fluorophenyl)methyl)piperazine1carboxamido)3methylbutanoicacid
1014003612
CC((C@@H)(C(=O)O)NC(=O)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)C
CC(C)C(C(=O)O)NC(=O)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F
InChI=1SC23H27F2N3O3c115(2)20(22(29)30)2623(31)28131127(121428)21(163718(24)8416)175919(25)10617h310152021H1114H212H3(H2631)(H2930)t20m0s1
MFCD07639603
N((4(bis(4fluorophenyl)methyl)piperazin1yl)carbonyl)Lvaline
ZINC000011767257
ZINC11767257

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Available files

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