Vitas-M small molecule compound

1-(N-{[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valyl)piperidine-4-carboxylic acid

Catalog ID
STK607685
SMILES CC([C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)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 C22H28FN3O5 MW 433.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28FN3O5/c1-13(2)19(21(29)25-9-7-14(8-10-25)22(30)31)24-20(28)15-11-18(27)26(12-15)17-5-3-16(23)4-6-17/h3-6,13-15,19H,7-12H2,1-2H3,(H,24,28)(H,30,31)/t15?,19-/m0/s1
InChIKey
WLOYPVYDCOGEME-FUBQLUNQSA-N
Synonyms

1((2S)2((1(4fluorophenyl)5oxopyrrolidine3carbonyl)amino)3methylbutanoyl)piperidine4carboxylicacid
1(N((1(4fluorophenyl)5oxopyrrolidin3yl)carbonyl)Lvalyl)piperidine4carboxylicacid
CC((C@@H)(C(=O)N1CCC(CC1)C(=O)O)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)C
CC(C)C(C(=O)N1CCC(CC1)C(=O)O)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F
InChI=1SC22H28FN3O5c113(2)19(21(29)259714(81025)22(30)31)2420(28)151118(27)26(1215)175316(23)4617h36131519H712H212H3(H2428)(H3031)t15?19m0s1
MFCD18246225
ZINC000009487949
ZINC000009487951

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Available files

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