Vitas-M small molecule compound

Nalpha-({1-[N-(tert-butoxycarbonyl)-L-valyl]piperidin-4-yl}carbonyl)-N-(4-methylbenzyl)-L-phenylalaninamide

Catalog ID
STL537406
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)Cc1ccccc1)C(C)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 C33H46N4O5 MW 578.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H46N4O5/c1-22(2)28(36-32(41)42-33(4,5)6)31(40)37-18-16-26(17-19-37)29(38)35-27(20-24-10-8-7-9-11-24)30(39)34-21-25-14-12-23(3)13-15-25/h7-15,22,26-28H,16-21H2,1-6H3,(H,34,39)(H,35,38)(H,36,41)/t27-,28-/m0/s1
InChIKey
WQEBEVCPWIKAII-NSOVKSMOSA-N
Synonyms
956944-31-3
~(tert)butyl~(N)((2~(S))3methyl1(4(((2~(S))1((4methylphenyl)methylamino)1oxo3phenylpropan2yl)carbamoyl)piperidin1yl)1oxobutan2yl)carbamate
16399421
956944313
InChI=1SC33H46N4O5c122(2)28(3632(41)4233(45)6)31(40)37181626(171937)29(38)3527(2024108791124)30(39)342125141223(3)131525h715222628H1621H216H3(H3439)(H3538)(H3641)t2728m0s1
Nalpha((1(N(tertbutoxycarbonyl)Lvalyl)piperidin4yl)carbonyl)N(4methylbenzyl)Lphenylalaninamide
O=C(OC(C)(C)C)N(C@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)NCc1ccc(cc1)C)Cc1ccccc1)C(C)C
tertbutyl((S)3methyl1(4(((S)1((4methylbenzyl)amino)1oxo3phenylpropan2yl)carbamoyl)piperidin1yl)1oxobutan2yl)carbamate
ZINC000070681165
ZINC70681165

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Available files

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