Vitas-M small molecule compound
4-chloro-5-[4-(4-nitrophenyl)piperazin-1-yl]-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridazin-3(2H)-one
Catalog ID
STK171882
SMILES Clc1c(cnn(c1=O)C12CC3CC(C2)CC(C1)C3)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
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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 C24H28ClN5O3 MW 469.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN5O3/c25-22-21(28-7-5-27(6-8-28)19-1-3-20(4-2-19)30(32)33)15-26-29(23(22)31)24-12-16-9-17(13-24)11-18(10-16)14-24/h1-4,15-18H,5-14H2InChIKey
LCANOFXMITUJST-UHFFFAOYSA-NSynonyms
2(1ADAMANTYL)4CHLORO5(4(4NITROPHENYL)PIPERAZIN1YL)PYRIDAZIN3ONE
4chloro5(4(4nitrophenyl)piperazin1yl)2(tricyclo(3311~37~)dec1yl)pyridazin3(2H)one
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)C5)Cl
Clc1c(cnn(c1=O)C12CC3CC(C2)CC(C1)C3)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H28ClN5O3c252221(287527(6828)191320(4219)30(32)33)152629(23(22)31)241216917(1324)1118(1016)1424h141518H514H2
MFCD04074371
ZINC000009891897
ZINC09891897
ZINC9891897
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