Vitas-M small molecule compound

tert-butyl 4-({(2S)-1-[(4-methylbenzyl)amino]-1-oxo-3-phenylpropan-2-yl}carbamoyl)piperidine-1-carboxylate

Catalog ID
STK571849
SMILES O=C([C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)OC(C)(C)C)NCc1ccc(cc1)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 C28H37N3O4 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O4/c1-20-10-12-22(13-11-20)19-29-26(33)24(18-21-8-6-5-7-9-21)30-25(32)23-14-16-31(17-15-23)27(34)35-28(2,3)4/h5-13,23-24H,14-19H2,1-4H3,(H,29,33)(H,30,32)/t24-/m0/s1
InChIKey
QXVMXUKRVOHLCD-DEOSSOPVSA-N
Synonyms
1014042-94-4
(S)tertbutyl4((1((4methylbenzyl)amino)1oxo3phenylpropan2yl)carbamoyl)piperidine1carboxylate
1014042944
CC1=CC=C(C=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C
InChI=1SC28H37N3O4c120101222(131120)192926(33)24(18218657921)3025(32)23141631(171523)27(34)3528(23)4h5132324H1419H214H3(H2933)(H3032)t24m0s1
MFCD04162177
O=C((C@H)(Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)OC(C)(C)C)NCc1ccc(cc1)C
tertbutyl4(((2S)1((4methylbenzyl)amino)1oxo3phenylpropan2yl)carbamoyl)piperidine1carboxylate
tertbutyl4(((2S)1((4methylphenyl)methylamino)1oxo3phenylpropan2yl)carbamoyl)piperidine1carboxylate
ZINC000009453492
ZINC09453492
ZINC9453492

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Available files

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