Vitas-M small molecule compound

ethyl 5-methoxy-3-[(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propanoyl)amino]-1H-indole-2-carboxylate

Catalog ID
STL343893
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)OC

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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 C26H29F3N4O4 MW 518.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29F3N4O4/c1-3-37-25(35)24-23(20-16-19(36-2)7-8-21(20)30-24)31-22(34)9-10-32-11-13-33(14-12-32)18-6-4-5-17(15-18)26(27,28)29/h4-8,15-16,30H,3,9-14H2,1-2H3,(H,31,34)
InChIKey
KLDXOGRUNFLDLK-UHFFFAOYSA-N
Synonyms
396098-88-7
396098887
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)OC
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
ethyl5methoxy3((3(4(3(trifluoromethyl)phenyl)piperazin1yl)propanoyl)amino)1Hindole2carboxylate
ethyl5methoxy3(3(4(3(trifluoromethyl)phenyl)piperazin1yl)propanamido)1Hindole2carboxylate
ETHYL5METHOXY3(3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
InChI=1SC26H29F3N4O4c133725(35)2423(201619(362)7821(20)3024)3122(34)91032111333(141232)1864517(1518)26(2728)29h48151630H3914H212H3(H3134)
MFCD02237900
ZINC000009282044
ZINC9282044

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Available files

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