Vitas-M small molecule compound

(2S)-({[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}amino)(phenyl)ethanoic acid

Catalog ID
STK573691
SMILES O=C(N1CCC(CC1)(c1ccccc1)C(=O)N[C@@H](c1ccccc1)C(=O)O)OC(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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-24(2,3)32-23(31)27-16-14-25(15-17-27,19-12-8-5-9-13-19)22(30)26-20(21(28)29)18-10-6-4-7-11-18/h4-13,20H,14-17H2,1-3H3,(H,26,30)(H,28,29)/t20-/m0/s1
InChIKey
KACRPTLABQJCPU-FQEVSTJZSA-N
Synonyms
1014044-32-6
(2S)(((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)amino)(phenyl)ethanoicacid
(2S)2((1((2methylpropan2yl)oxycarbonyl)4phenylpiperidine4carbonyl)amino)2phenylaceticacid
(S)2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)2phenylaceticacid
1014044326
CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(C3=CC=CC=C3)C(=O)O
InChI=1SC25H30N2O5c124(23)3223(31)27161425(15172719128591319)22(30)2620(21(28)29)18106471118h41320H1417H213H3(H2630)(H2829)t20m0s1
MFCD06610406
O=C(N1CCC(CC1)(c1ccccc1)C(=O)N(C@@H)(c1ccccc1)C(=O)O)OC(C)(C)C
ZINC000009237092
ZINC9237092

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Available files

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