Vitas-M small molecule compound

(2-chloro-4,5-difluorophenyl){4-[3-(morpholin-4-yl)-4-nitrophenyl]piperazin-1-yl}methanone

Catalog ID
STK032620
SMILES Clc1cc(F)c(cc1C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)[N+](=O)[O-])F

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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 C21H21ClF2N4O4 MW 466.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClF2N4O4/c22-16-13-18(24)17(23)12-15(16)21(29)27-5-3-25(4-6-27)14-1-2-19(28(30)31)20(11-14)26-7-9-32-10-8-26/h1-2,11-13H,3-10H2
InChIKey
MYCMDPBZTJGUID-UHFFFAOYSA-N
Synonyms

(2CHLORO45DIFLUOROPHENYL)(4(3(MORPHOLIN4YL)4NITROPHENYL)PIPERAZIN1YL)METHANONE
(2CHLORO45DIFLUOROPHENYL)(4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZIN1YL)METHANONE
(2chloro45difluorophenyl)(4(3morpholino4nitrophenyl)piperazin1yl)methanone
2CHLORO45DIFLUOROPHENYL4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))N3CCOCC3)C(=O)C4=CC(=C(C=C4Cl)F)F
Clc1cc(F)c(cc1C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)(N+)(=O)(O))F
InChI=1SC21H21ClF2N4O4c22161318(24)17(23)1215(16)21(29)275325(4627)141219(28(30)31)20(1114)26793210826h121113H310H2
MFCD01173877
STK032620
ZINC000004046013
ZINC04046013
ZINC4046013

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Available files

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