Vitas-M small molecule compound
1-(2-hydroxy-3-phenoxypropyl)-4-[(4-methoxyphenyl)carbonyl]piperazin-1-ium
Catalog ID
STK370140
SMILES COc1ccc(cc1)C(=O)N1CC[NH+](CC1)CC(COc1ccccc1)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 C21H27N2O4 MW 371.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4/c1-26-19-9-7-17(8-10-19)21(25)23-13-11-22(12-14-23)15-18(24)16-27-20-5-3-2-4-6-20/h2-10,18,24H,11-16H2,1H3/p+1InChIKey
MMWLIQYSESDIEH-UHFFFAOYSA-OSynonyms
(4(2HYDROXY3PHENOXYPROPYL)PIPERAZIN4IUM1YL)(4METHOXYPHENYL)METHANONE
1(2hydroxy3phenoxypropyl)4((4methoxyphenyl)carbonyl)piperazin1ium
COC1=CC=C(C=C1)C(=O)N2CC(NH+)(CC2)CC(COC3=CC=CC=C3)O
COc1ccc(cc1)C(=O)N1CC(NH+)(CC1)CC(COc1ccccc1)O
InChI=1SC21H26N2O4c126199717(81019)21(25)23131122(121423)1518(24)1627205324620h2101824H1116H21H3p+1
MFCD00353599
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