Vitas-M small molecule compound
4-[3-(4-fluorophenyl)-11-(5-nitrofuran-2-yl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Catalog ID
STL023747
SMILES OC(=O)CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(o1)[N+](=O)[O-])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 C27H22FN3O7 MW 519.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O7/c28-17-7-5-15(6-8-17)16-13-19-26(21(32)14-16)27(22-9-11-24(38-22)31(36)37)30(23(33)10-12-25(34)35)20-4-2-1-3-18(20)29-19/h1-9,11,16,27,29H,10,12-14H2,(H,34,35)InChIKey
FOKFABPMITUVQY-UHFFFAOYSA-NSynonyms
4(3(4FLUOROPHENYL)11(5NITRO(2FURYL))1OXO(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(3(4fluorophenyl)11(5nitrofuran2yl)1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(9(4fluorophenyl)6(5nitrofuran2yl)7oxo891011tetrahydro6Hbenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC=C(O4)(N+)(=O)(O))C(=O)CCC(=O)O)C5=CC=C(C=C5)F
InChI=1SC27H22FN3O7c28177515(6817)16131926(21(32)1416)27(2291124(3822)31(36)37)30(23(33)101225(34)35)20421318(20)2919h1911162729H101214H2(H3435)
MFCD02375506
OC(=O)CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(o1)(N+)(=O)(O))C(=O)CC(C2)c1ccc(cc1)F
ZINC000000893659
ZINC000006475034
Check stock
See real-time availability and sample size for STL023747 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.