Vitas-M small molecule compound
methyl 3-({3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]propanoyl}amino)-5-fluoro-1H-indole-2-carboxylate
Catalog ID
STK553746
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccc3c(c1)OCO3)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 C25H27FN4O5 MW 482.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27FN4O5/c1-33-25(32)24-23(18-13-17(26)3-4-19(18)27-24)28-22(31)6-7-29-8-10-30(11-9-29)14-16-2-5-20-21(12-16)35-15-34-20/h2-5,12-13,27H,6-11,14-15H2,1H3,(H,28,31)InChIKey
ZJTSYYRVMQIOTN-UHFFFAOYSA-NSynonyms
840463-32-3840463323
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccc3c(c1)OCO3)cc(cc2)F
COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC25H27FN4O5c13325(32)2423(181317(26)3419(18)2724)2822(31)672981030(11929)1416252021(1216)35153420h25121327H6111415H21H3(H2831)
methyl3((3(4(13benzodioxol5ylmethyl)piperazin1yl)propanoyl)amino)5fluoro1Hindole2carboxylate
METHYL3(3(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)PROPANOYLAMINO)5FLUORO1HINDOLE2CARBOXYLATE
methyl3(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)propanamido)5fluoro1Hindole2carboxylate
MFCD04004688
ZINC000020262898
ZINC20262898
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