Vitas-M small molecule compound

methyl 3-{[3-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)propanoyl]amino}-5-fluoro-1H-indole-2-carboxylate

Catalog ID
STK554376
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC3(CC1)OCCO3)cc(cc2)F

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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 C20H24FN3O5 MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24FN3O5/c1-27-19(26)18-17(14-12-13(21)2-3-15(14)22-18)23-16(25)4-7-24-8-5-20(6-9-24)28-10-11-29-20/h2-3,12,22H,4-11H2,1H3,(H,23,25)
InChIKey
ADHUVMWOLLHDOM-UHFFFAOYSA-N
Synonyms
840473-32-7
840473327
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CCC3(CC1)OCCO3)cc(cc2)F
COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCC4(CC3)OCCO4
InChI=1SC20H24FN3O5c12719(26)1817(141213(21)2315(14)2218)2316(25)47248520(6924)2810112920h231222H411H21H3(H2325)
methyl3((3(14dioxa8azaspiro(45)dec8yl)propanoyl)amino)5fluoro1Hindole2carboxylate
methyl3(3(14dioxa8azaspiro(45)decan8yl)propanamido)5fluoro1Hindole2carboxylate
METHYL3(3(14DIOXA8AZASPIRO(45)DECAN8YL)PROPANOYLAMINO)5FLUORO1HINDOLE2CARBOXYLATE
MFCD04005640
ZINC000002261687
ZINC2261687

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Available files

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