Vitas-M small molecule compound

methyl 3-({3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoyl}amino)-5-fluoro-1H-indole-2-carboxylate

Catalog ID
STL345047
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)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 C24H26ClFN4O3 MW 472.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClFN4O3/c1-15-3-4-16(25)13-20(15)30-11-9-29(10-12-30)8-7-21(31)28-22-18-14-17(26)5-6-19(18)27-23(22)24(32)33-2/h3-6,13-14,27H,7-12H2,1-2H3,(H,28,31)
InChIKey
NCOWFDXOPOPBNM-UHFFFAOYSA-N
Synonyms
847177-13-3
847177133
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCC(=O)NC3=C(NC4=C3C=C(C=C4)F)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cc(cc2)F
InChI=1SC24H26ClFN4O3c1153416(25)1320(15)3011929(101230)8721(31)2822181417(26)5619(18)2723(22)24(32)332h36131427H712H212H3(H2831)
methyl3((3(4(5chloro2methylphenyl)piperazin1yl)propanoyl)amino)5fluoro1Hindole2carboxylate
methyl3(3(4(5chloro2methylphenyl)piperazin1yl)propanamido)5fluoro1Hindole2carboxylate
METHYL3(3(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)5FLUORO1HINDOLE2CARBOXYLATE
MFCD04183745
ZINC000002393129
ZINC2393129

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Available files

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