Vitas-M small molecule compound
[4-(dibenzo[b,f][1,4]oxazepin-11-yl)piperazin-1-yl](7-methoxy-1H-indol-3-yl)acetic acid
Catalog ID
STL237869
SMILES COc1cccc2c1[nH]cc2C(N1CCN(CC1)C1=Nc2ccccc2Oc2c1cccc2)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 C28H26N4O4 MW 482.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4/c1-35-24-12-6-8-18-20(17-29-25(18)24)26(28(33)34)31-13-15-32(16-14-31)27-19-7-2-4-10-22(19)36-23-11-5-3-9-21(23)30-27/h2-12,17,26,29H,13-16H2,1H3,(H,33,34)InChIKey
DXQUNKOCYDDFIW-UHFFFAOYSA-NSynonyms
1081124-38-0(4(dibenzo(bf)(14)oxazepin11yl)piperazin1yl)(7methoxy1Hindol3yl)aceticacid
1081124380
2(4(dibenzo(bf)(14)oxazepin11yl)piperazin1yl)2(7methoxy1Hindol3yl)aceticacid
2(4benzo(b)(14)benzoxazepin6ylpiperazin1yl)2(7methoxy1Hindol3yl)aceticacid
COC1=CC=CC2=C1NC=C2C(C(=O)O)N3CCN(CC3)C4=NC5=CC=CC=C5OC6=CC=CC=C64
COc1cccc2c1(nH)cc2C(N1CCN(CC1)C1=Nc2ccccc2Oc2c1cccc2)C(=O)O
InChI=1SC28H26N4O4c1352412681820(172925(18)24)26(28(33)34)31131532(161431)27197241022(19)36231153921(23)3027h212172629H1316H21H3(H3334)
MFCD12208816
ZINC000020735589
ZINC000020735592
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