Vitas-M small molecule compound

N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-L-valine

Catalog ID
STK575073
SMILES CC([C@@H](C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)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 C22H32N2O5 MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O5/c1-15(2)17(18(25)26)23-19(27)22(16-9-7-6-8-10-16)11-13-24(14-12-22)20(28)29-21(3,4)5/h6-10,15,17H,11-14H2,1-5H3,(H,23,27)(H,25,26)/t17-/m0/s1
InChIKey
UKVWFTDBYCGOFA-KRWDZBQOSA-N
Synonyms
958845-82-4
(2S)2((1TERTBUTOXYCARBONYL4PHENYLISONIPECOTOYL)AMINO)3METHYLBUTYRICACID
(2S)3METHYL2(((1((2METHYLPROPAN2YL)OXYOXOMETHYL)4PHENYL4PIPERIDINYL)OXOMETHYL)AMINO)BUTANOICACID
(2S)3METHYL2((1((2METHYLPROPAN2YL)OXYCARBONYL)4PHENYLPIPERIDIN4YL)CARBONYLAMINO)BUTANOICACID
(2S)3METHYL2((1((2METHYLPROPAN2YL)OXYCARBONYL)4PHENYLPIPERIDINE4CARBONYL)AMINO)BUTANOICACID
(S)2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)3methylbutanoicacid
958845824
CC((C@@H)(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C
CC(C)C(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2
InChI=1SC22H32N2O5c115(2)17(18(25)26)2319(27)22(1697681016)111324(141222)20(28)2921(34)5h6101517H1114H215H3(H2327)(H2526)t17m0s1
MFCD06605806
N((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)Lvaline
ZINC000004283147
ZINC4283147

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Available files

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