Vitas-M small molecule compound

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

Catalog ID
STK582172
SMILES COc1ccc(cc1)CNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(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 C31H42N4O6 MW 566.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H42N4O6/c1-21(33-30(39)41-31(2,3)4)29(38)35-17-15-24(16-18-35)27(36)34-26(19-22-9-7-6-8-10-22)28(37)32-20-23-11-13-25(40-5)14-12-23/h6-14,21,24,26H,15-20H2,1-5H3,(H,32,37)(H,33,39)(H,34,36)/t21-,26-/m0/s1
InChIKey
PZJQJZDYVICTQP-LVXARBLLSA-N
Synonyms
1212590-23-2
1212590232
CC(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)OC)NC(=O)OC(C)(C)C
COc1ccc(cc1)CNC(=O)(C@H)(Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)(C@@H)(NC(=O)OC(C)(C)C)C
InChI=1SC31H42N4O6c121(3330(39)4131(23)4)29(38)35171524(161835)27(36)3426(192297681022)28(37)322023111325(405)141223h614212426H1520H215H3(H3237)(H3339)(H3436)t2126m0s1
MFCD04145901
Nalpha((1(N(tertbutoxycarbonyl)Lalanyl)piperidin4yl)carbonyl)N(4methoxybenzyl)Lphenylalaninamide
tertbutyl((S)1(4(((S)1((4methoxybenzyl)amino)1oxo3phenylpropan2yl)carbamoyl)piperidin1yl)1oxopropan2yl)carbamate
tertbutylN((2S)1(4(((2S)1((4methoxyphenyl)methylamino)1oxo3phenylpropan2yl)carbamoyl)piperidin1yl)1oxopropan2yl)carbamate
ZINC000101670237
ZINC101670237

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Available files

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