Vitas-M small molecule compound
1H-indol-3-yl{4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl}acetic acid
Catalog ID
STK660396
SMILES OC(=O)C(c1c[nH]c2c1cccc2)N1CCCN(CC1)c1ccc(cn1)C(F)(F)F
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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 C21H21F3N4O2 MW 418.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4O2/c22-21(23,24)14-6-7-18(26-12-14)27-8-3-9-28(11-10-27)19(20(29)30)16-13-25-17-5-2-1-4-15(16)17/h1-2,4-7,12-13,19,25H,3,8-11H2,(H,29,30)InChIKey
QMXLYGVMAQZJFH-UHFFFAOYSA-NSynonyms
1144494-08-51144494085
1Hindol3yl(4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)aceticacid
2(1Hindol3yl)2(4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)aceticacid
C1CN(CCN(C1)C(C2=CNC3=CC=CC=C32)C(=O)O)C4=NC=C(C=C4)C(F)(F)F
InChI=1SC21H21F3N4O2c2221(2324)146718(261214)2783928(111027)19(20(29)30)16132517521415(16)17h124712131925H3811H2(H2930)
MFCD12211899
OC(=O)C(c1c(nH)c2c1cccc2)N1CCCN(CC1)c1ccc(cn1)C(F)(F)F
ZINC000032073508
ZINC000032073510
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