Vitas-M small molecule compound

4-[3-(4-fluorophenyl)-1-oxo-11-(pyridin-3-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid

Catalog ID
STK091470
SMILES OC(=O)CCC(=O)N1c2ccccc2NC2=C(C1c1cccnc1)C(=O)CC(C2)c1ccc(cc1)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 C28H24FN3O4 MW 485.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN3O4/c29-20-9-7-17(8-10-20)19-14-22-27(24(33)15-19)28(18-4-3-13-30-16-18)32(25(34)11-12-26(35)36)23-6-2-1-5-21(23)31-22/h1-10,13,16,19,28,31H,11-12,14-15H2,(H,35,36)
InChIKey
RWQGMRKFRYWTLL-UHFFFAOYSA-N
Synonyms
523992-88-3
4(3(4FLUOROPHENYL)1OXO11(3PYRIDYL)(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(3(4fluorophenyl)1oxo11(pyridin3yl)1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(3(4fluorophenyl)1oxo11(pyridin3yl)34dihydro1Hdibenzo(be)(14)diazepin10(2H5H11H)yl)4oxobutanoicacid
4(9(4fluorophenyl)7oxo6pyridin3yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
523992883
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CN=CC=C4)C(=O)CCC(=O)O)C5=CC=C(C=C5)F
InChI=1SC28H24FN3O4c29209717(81020)19142227(24(33)1519)28(184313301618)32(25(34)111226(35)36)23621521(23)3122h1101316192831H11121415H2(H3536)
MFCD03488992
OC(=O)CCC(=O)N1c2ccccc2NC2=C(C1c1cccnc1)C(=O)CC(C2)c1ccc(cc1)F
STK091470
ZINC000004450720
ZINC000009425272

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Available files

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