Vitas-M small molecule compound

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

Catalog ID
STL018464
SMILES CCN1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)OCC(=O)NC(CC)C)C1CC1

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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 C25H33FN4O4 MW 472.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33FN4O4/c1-4-16(3)27-23(31)15-34-25(33)19-14-30(17-6-7-17)21-13-22(20(26)12-18(21)24(19)32)29-10-8-28(5-2)9-11-29/h12-14,16-17H,4-11,15H2,1-3H3,(H,27,31)
InChIKey
VCOBAGUETXATTC-UHFFFAOYSA-N
Synonyms

(2(butan2ylamino)2oxoethyl)1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxoquinoline3carboxylate
2(butan2ylamino)2oxoethyl1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxo14dihydroquinoline3carboxylate
CCC(C)NC(=O)COC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)CC)C4CC4
InChI=1SC25H33FN4O4c1416(3)2723(31)153425(33)191430(176717)211322(20(26)1218(21)24(19)32)2910828(52)91129h12141617H41115H213H3(H2731)
MFCD18186965
ZINC000051364300
ZINC000051364301

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Available files

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