Vitas-M small molecule compound

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

Catalog ID
STK608599
SMILES OCCCNC(=O)[C@@H](NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)CC(C)C

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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 C22H29N3O6 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O6/c1-4-25-11-15(20(27)14-9-18-19(10-17(14)25)31-12-30-18)21(28)24-16(8-13(2)3)22(29)23-6-5-7-26/h9-11,13,16,26H,4-8,12H2,1-3H3,(H,23,29)(H,24,28)/t16-/m0/s1
InChIKey
QJWGFGYXOUMNFO-INIZCTEOSA-N
Synonyms
1014087-19-4
(S)5ethylN(1((3hydroxypropyl)amino)4methyl1oxopentan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
1014087194
5ethylN((2S)1((3hydroxypropyl)amino)4methyl1oxopentan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(3hydroxypropylamino)4methyl1oxopentan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CC(C)C)C(=O)NCCCO
InChI=1SC22H29N3O6c14251115(20(27)1491819(1017(14)25)31123018)21(28)2416(813(2)3)22(29)2365726h911131626H4812H213H3(H2329)(H2428)t16m0s1
MFCD08749709
OCCCNC(=O)(C@@H)(NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)CC(C)C
ZINC000009418520
ZINC09418520
ZINC9418520

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Available files

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