Vitas-M small molecule compound
[1-(carboxymethyl)-1H-indol-3-yl]{4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl}acetic acid
Catalog ID
STK660013
SMILES OC(=O)Cn1cc(c2c1cccc2)C(N1CCCN(CC1)c1ccc(cn1)C(F)(F)F)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 C23H23F3N4O4 MW 476.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23F3N4O4/c24-23(25,26)15-6-7-19(27-12-15)28-8-3-9-29(11-10-28)21(22(33)34)17-13-30(14-20(31)32)18-5-2-1-4-16(17)18/h1-2,4-7,12-13,21H,3,8-11,14H2,(H,31,32)(H,33,34)InChIKey
UWPZMKLTDJYSKZ-UHFFFAOYSA-NSynonyms
1214050-04-0(1(carboxymethyl)1Hindol3yl)(4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)aceticacid
1214050040
2(1(carboxymethyl)1Hindol3yl)2(4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)aceticacid
2(1(carboxymethyl)indol3yl)2(4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)aceticacid
C1CN(CCN(C1)C(C2=CN(C3=CC=CC=C32)CC(=O)O)C(=O)O)C4=NC=C(C=C4)C(F)(F)F
InChI=1SC23H23F3N4O4c2423(2526)156719(271215)2883929(111028)21(22(33)34)171330(1420(31)32)18521416(17)18h1247121321H381114H2(H3132)(H3334)
MFCD13760841
ZINC000036366419
ZINC000036366421
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