Vitas-M small molecule compound

5-ethyl-8-oxo-N-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STK610871
SMILES CCn1cc(C(=O)N[C@H](C(=O)N2CCN(CC2)c2ccccn2)C)c(=O)c2c1cc1OCOc1c2

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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 C25H27N5O5 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O5/c1-3-28-14-18(23(31)17-12-20-21(13-19(17)28)35-15-34-20)24(32)27-16(2)25(33)30-10-8-29(9-11-30)22-6-4-5-7-26-22/h4-7,12-14,16H,3,8-11,15H2,1-2H3,(H,27,32)/t16-/m0/s1
InChIKey
NDCFVTRBGWSWFT-INIZCTEOSA-N
Synonyms
956969-26-9
(S)5ethyl8oxoN(1oxo1(4(pyridin2yl)piperazin1yl)propan2yl)58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethyl8oxoN((2S)1oxo1(4(pyridin2yl)piperazin1yl)propan2yl)58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethyl8oxoN((2S)1oxo1(4pyridin2ylpiperazin1yl)propan2yl)(13)dioxolo(45g)quinoline7carboxamide
956969269
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C)C(=O)N4CCN(CC4)C5=CC=CC=N5
CCn1cc(C(=O)N(C@H)(C(=O)N2CCN(CC2)c2ccccn2)C)c(=O)c2c1cc1OCOc1c2
InChI=1SC25H27N5O5c13281418(23(31)17122021(1319(17)28)35153420)24(32)2716(2)25(33)3010829(91130)2264572622h47121416H381115H212H3(H2732)t16m0s1
MFCD08745694
ZINC000009184318
ZINC9184318

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Available files

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