Vitas-M small molecule compound
3-(6-bromo-3-{carboxy[4-(pyridin-2-yl)piperazin-1-yl]methyl}-1H-indol-1-yl)propanoic acid
Catalog ID
STK655373
SMILES OC(=O)CCn1cc(c2c1cc(Br)cc2)C(N1CCN(CC1)c1ccccn1)C(=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 C22H23BrN4O4 MW 487.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN4O4/c23-15-4-5-16-17(14-27(18(16)13-15)8-6-20(28)29)21(22(30)31)26-11-9-25(10-12-26)19-3-1-2-7-24-19/h1-5,7,13-14,21H,6,8-12H2,(H,28,29)(H,30,31)InChIKey
PZSFEIYOIKIJFR-UHFFFAOYSA-NSynonyms
1214820-98-01214820980
3(6bromo3(carboxy(4(pyridin2yl)piperazin1yl)methyl)1Hindol1yl)propanoicacid
3(6bromo3(carboxy(4pyridin2ylpiperazin1yl)methyl)indol1yl)propanoicacid
C1CN(CCN1C2=CC=CC=N2)C(C3=CN(C4=C3C=CC(=C4)Br)CCC(=O)O)C(=O)O
InChI=1SC22H23BrN4O4c2315451617(1427(18(16)1315)8620(28)29)21(22(30)31)2611925(101226)1931272419h157131421H6812H2(H2829)(H3031)
MFCD13758349
ZINC000036358942
ZINC000036358943
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