Vitas-M small molecule compound

5-ethyl-N-((2S,3S)-1-((2-(2-hydroxyethoxy)ethyl)amino)-3-methyl-1-oxopentan-2-yl)-8-oxo-5,8-dihydro-[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STL010878
SMILES OCCOCCNC(=O)[C@H](C(CC)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

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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 C23H31N3O7 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O7/c1-4-14(3)20(23(30)24-6-8-31-9-7-27)25-22(29)16-12-26(5-2)17-11-19-18(32-13-33-19)10-15(17)21(16)28/h10-12,14,20,27H,4-9,13H2,1-3H3,(H,24,30)(H,25,29)/t14?,20-/m0/s1
InChIKey
JXTZLIHQJQDAQC-LGTGAQBVSA-N
Synonyms
956948-80-4
5ethylN((2S)1(2(2hydroxyethoxy)ethylamino)3methyl1oxopentan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S3S)1((2(2hydroxyethoxy)ethyl)amino)3methyl1oxopentan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
956948804
CCC(C)C(C(=O)NCCOCCO)NC(=O)C1=CN(C2=CC3=C(C=C2C1=O)OCO3)CC
InChI=1SC23H31N3O7c1414(3)20(23(30)2468319727)2522(29)161226(52)17111918(32133319)1015(17)21(16)28h1012142027H4913H213H3(H2430)(H2529)t14?20m0s1
MFCD10487927
OCCOCCNC(=O)(C@H)(C(CC)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
ZINC000012892857
ZINC000012892864

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Available files

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