Vitas-M small molecule compound

tert-butyl {(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate

Catalog ID
STL537534
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C)Cc1ccccc1

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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 C29H37FN4O5 MW 540.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37FN4O5/c1-19(25(35)32-23-12-10-22(30)11-13-23)31-26(36)21-14-16-34(17-15-21)27(37)24(18-20-8-6-5-7-9-20)33-28(38)39-29(2,3)4/h5-13,19,21,24H,14-18H2,1-4H3,(H,31,36)(H,32,35)(H,33,38)/t19-,24-/m0/s1
InChIKey
VYGFDHBCFPESKQ-CYFREDJKSA-N
Synonyms
957044-40-5
~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(4fluoroanilino)1oxopropan2yl)carbamoyl)piperidin1yl)1oxo3phenylpropan2yl)carbamate
16399531
957044405
InChI=1SC29H37FN4O5c119(25(35)3223121022(30)111323)3126(36)21141634(171521)27(37)24(18208657920)3328(38)3929(23)4h513192124H1418H214H3(H3136)(H3235)(H3338)t1924m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc(cc1)F)C)Cc1ccccc1
tertbutyl((2S)1(4(((2S)1((4fluorophenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)1oxo3phenylpropan2yl)carbamate
tertbutyl((S)1(4(((S)1((4fluorophenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)1oxo3phenylpropan2yl)carbamate
ZINC000070686519
ZINC70686519

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Available files

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