Vitas-M small molecule compound
4-[3-(3,4-dimethoxyphenyl)-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
STK047076
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccnc1)C(=O)CCC(=O)O
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C30H29N3O6 MW 527.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O6/c1-38-25-10-9-18(16-26(25)39-2)20-14-22-29(24(34)15-20)30(19-6-5-13-31-17-19)33(27(35)11-12-28(36)37)23-8-4-3-7-21(23)32-22/h3-10,13,16-17,20,30,32H,11-12,14-15H2,1-2H3,(H,36,37)InChIKey
BOJMURBQDWGEOG-UHFFFAOYSA-NSynonyms
4(3(34DIMETHOXYPHENYL)1OXO11(3PYRIDYL)(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(3(34dimethoxyphenyl)1oxo11(pyridin3yl)1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(9(34dimethoxyphenyl)7oxo6pyridin3yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
COC1=C(C=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)CCC(=O)O)C5=CN=CC=C5)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccnc1)C(=O)CCC(=O)O
InChI=1SC30H29N3O6c1382510918(1626(25)392)20142229(24(34)1520)30(196513311719)33(27(35)111228(36)37)23843721(23)3222h310131617203032H11121415H212H3(H3637)
MFCD03488983
STK047076
ZINC000008432796
ZINC000008432799
Check stock
See real-time availability and sample size for STK047076 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.