Vitas-M small molecule compound
4-{4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitrophenyl}phthalazin-1(2H)-one
Catalog ID
STK238637
SMILES OCCN1CCN(CC1)c1ccc(cc1[N+](=O)[O-])c1n[nH]c(=O)c2c1cccc2
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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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c26-12-11-23-7-9-24(10-8-23)17-6-5-14(13-18(17)25(28)29)19-15-3-1-2-4-16(15)20(27)22-21-19/h1-6,13,26H,7-12H2,(H,22,27)InChIKey
JVGZJWWLNKHHPR-UHFFFAOYSA-NSynonyms
573941-30-74(4(4(2HYDROXYETHYL)PIPERAZIN1YL)3NITROPHENYL)2HPHTHALAZIN1ONE
4(4(4(2hydroxyethyl)piperazin1yl)3nitrophenyl)phthalazin1(2H)one
573941307
C1CN(CCN1CCO)C2=C(C=C(C=C2)C3=NNC(=O)C4=CC=CC=C43)(N+)(=O)(O)
InChI=1SC20H21N5O4c261211237924(10823)176514(1318(17)25(28)29)1915312416(15)20(27)222119h161326H712H2(H2227)
MFCD03855593
OCCN1CCN(CC1)c1ccc(cc1(N+)(=O)(O))c1n(nH)c(=O)c2c1cccc2
ZINC000019856982
ZINC19856982
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