Vitas-M small molecule compound

methyl 1-{N-[(5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)carbonyl]-L-leucyl}piperidine-4-carboxylate

Catalog ID
STK604347
SMILES COC(=O)C1CCN(CC1)C(=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 C26H33N3O7 MW 499.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O7/c1-5-28-13-18(23(30)17-11-21-22(12-20(17)28)36-14-35-21)24(31)27-19(10-15(2)3)25(32)29-8-6-16(7-9-29)26(33)34-4/h11-13,15-16,19H,5-10,14H2,1-4H3,(H,27,31)/t19-/m0/s1
InChIKey
FVWFBUUCMNMSCD-IBGZPJMESA-N
Synonyms
1014063-35-4
(S)methyl1(2(5ethyl8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamido)4methylpentanoyl)piperidine4carboxylate
1014063354
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CC(C)C)C(=O)N4CCC(CC4)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)(C@@H)(NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)CC(C)C
InChI=1SC26H33N3O7c15281318(23(30)17112122(1220(17)28)36143521)24(31)2719(1015(2)3)25(32)298616(7929)26(33)344h1113151619H51014H214H3(H2731)t19m0s1
methyl1((2S)2((5ethyl8oxo(13)dioxolo(45g)quinoline7carbonyl)amino)4methylpentanoyl)piperidine4carboxylate
methyl1(N((5ethyl8oxo58dihydro(13)dioxolo(45g)quinolin7yl)carbonyl)Lleucyl)piperidine4carboxylate
MFCD08746283
ZINC000009303480
ZINC09303480
ZINC9303480

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Available files

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