Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxo-2-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}butanoic acid
Catalog ID
STL162547
SMILES O=C(CC(C(=O)O)CN1CCN(CC1)c1ccccn1)Nc1ccc2c(c1)OCCO2
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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 C22H26N4O5 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O5/c27-21(24-17-4-5-18-19(14-17)31-12-11-30-18)13-16(22(28)29)15-25-7-9-26(10-8-25)20-3-1-2-6-23-20/h1-6,14,16H,7-13,15H2,(H,24,27)(H,28,29)InChIKey
PKYPCWNBUAQACD-UHFFFAOYSA-NSynonyms
1282125-84-11282125841
4((23dihydrobenzo(b)(14)dioxin6yl)amino)4oxo2((4(pyridin2yl)piperazin1yl)methyl)butanoicacid
4(23dihydro14benzodioxin6ylamino)4oxo2((4(pyridin2yl)piperazin1yl)methyl)butanoicacid
4(23dihydro14benzodioxin6ylamino)4oxo2((4pyridin2ylpiperazin1yl)methyl)butanoicacid
C1CN(CCN1CC(CC(=O)NC2=CC3=C(C=C2)OCCO3)C(=O)O)C4=CC=CC=N4
InChI=1SC22H26N4O5c2721(2417451819(1417)3112113018)1316(22(28)29)15257926(10825)2031262320h161416H71315H2(H2427)(H2829)
MFCD18800010
ZINC000061721725
ZINC000061721726
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