Vitas-M small molecule compound

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

Catalog ID
STK716625
SMILES COC(=O)[C@@H](NC(=O)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)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 C28H29F2N3O3 MW 493.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29F2N3O3/c1-36-27(34)25(19-20-5-3-2-4-6-20)31-28(35)33-17-15-32(16-18-33)26(21-7-11-23(29)12-8-21)22-9-13-24(30)14-10-22/h2-14,25-26H,15-19H2,1H3,(H,31,35)/t25-/m0/s1
InChIKey
UHDAASJMMFQMAG-VWLOTQADSA-N
Synonyms
1014087-13-8
(S)methyl2(4(bis(4fluorophenyl)methyl)piperazine1carboxamido)3phenylpropanoate
1014087138
COC(=O)(C@@H)(NC(=O)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)Cc1ccccc1
COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F
InChI=1SC28H29F2N3O3c13627(34)25(19205324620)3128(35)33171532(161833)26(2171123(29)12821)2291324(30)141022h2142526H1519H21H3(H3135)t25m0s1
methyl(2S)2((4(bis(4fluorophenyl)methyl)piperazine1carbonyl)amino)3phenylpropanoate
methylN((4(bis(4fluorophenyl)methyl)piperazin1yl)carbonyl)Lphenylalaninate
MFCD07640332
ZINC000020403774
ZINC20403774

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Available files

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