Vitas-M small molecule compound

2-tert-butoxy-2-oxoethyl 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

Catalog ID
STL018448
SMILES CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)OCC(=O)OC(C)(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 C25H32FN3O5 MW 473.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32FN3O5/c1-5-27-8-10-28(11-9-27)21-13-20-17(12-19(21)26)23(31)18(14-29(20)16-6-7-16)24(32)33-15-22(30)34-25(2,3)4/h12-14,16H,5-11,15H2,1-4H3
InChIKey
YXYMEJAPSHGYGT-UHFFFAOYSA-N
Synonyms

(2((2methylpropan2yl)oxy)2oxoethyl)1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxoquinoline3carboxylate
2tertbutoxy2oxoethyl1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxo14dihydroquinoline3carboxylate
CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCC(=O)OC(C)(C)C)C4CC4)F
InChI=1SC25H32FN3O5c152781028(11927)21132017(1219(21)26)23(31)18(1429(20)166716)24(32)331522(30)3425(23)4h121416H51115H214H3
MFCD18186949
ZINC000051364284
ZINC51364284

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Available files

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