Vitas-M small molecule compound
[4-(dibenzo[b,f][1,4]oxazepin-11-yl)piperazin-1-yl](5-methoxy-1H-indol-3-yl)acetic acid
Catalog ID
STK643133
SMILES COc1ccc2c(c1)c(c[nH]2)C(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/c1-35-18-10-11-22-20(16-18)21(17-29-22)26(28(33)34)31-12-14-32(15-13-31)27-19-6-2-4-8-24(19)36-25-9-5-3-7-23(25)30-27/h2-11,16-17,26,29H,12-15H2,1H3,(H,33,34)InChIKey
NBGPBDKJMLOMIJ-UHFFFAOYSA-NSynonyms
1040700-69-3(4(dibenzo(bf)(14)oxazepin11yl)piperazin1yl)(5methoxy1Hindol3yl)aceticacid
1040700693
2(4(dibenzo(bf)(14)oxazepin11yl)piperazin1yl)2(5methoxy1Hindol3yl)aceticacid
2(4benzo(b)(14)benzoxazepin6ylpiperazin1yl)2(5methoxy1Hindol3yl)aceticacid
COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C4=NC5=CC=CC=C5OC6=CC=CC=C64
COc1ccc2c(c1)c(c(nH)2)C(N1CCN(CC1)C1=Nc2ccccc2Oc2c1cccc2)C(=O)O
InChI=1SC28H26N4O4c1351810112220(1618)21(172922)26(28(33)34)31121432(151331)2719624824(19)3625953723(25)3027h21116172629H1215H21H3(H3334)
MFCD12207310
ZINC000020726839
ZINC000020726844
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