Vitas-M small molecule compound

4-butyl-N-(4-{[(4-hexylphenyl)carbonyl]amino}-9,10-dioxo-9,10-dihydroanthracen-1-yl)benzamide

Catalog ID
STK049365
SMILES CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)NC(=O)c1ccc(cc1)CCCC

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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 C38H38N2O4 MW 586.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H38N2O4/c1-3-5-7-8-12-26-17-21-28(22-18-26)38(44)40-32-24-23-31(39-37(43)27-19-15-25(16-20-27)11-6-4-2)33-34(32)36(42)30-14-10-9-13-29(30)35(33)41/h9-10,13-24H,3-8,11-12H2,1-2H3,(H,39,43)(H,40,44)
InChIKey
BJGMMJMTDKOGMR-UHFFFAOYSA-N
Synonyms

4BUTYLN(4(((4HEXYLPHENYL)CARBONYL)AMINO)910DIOXO910DIHYDROANTHRACEN1YL)BENZAMIDE
4BUTYLN(4((4HEXYLBENZOYL)AMINO)910DIOXOANTHRACEN1YL)BENZAMIDE
CCCCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC(=O)C4=CC=C(C=C4)CCCC)C(=O)C5=CC=CC=C5C3=O
CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)NC(=O)c1ccc(cc1)CCCC
InChI=1SC38H38N2O4c135781226172128(221826)38(44)4032242331(3937(43)27191525(162027)11642)3334(32)36(42)30141091329(30)35(33)41h9101324H381112H212H3(H3943)(H4044)
MFCD00603668
N(4((4BUTYLBENZOYL)AMINO)910DIOXO910DIHYDRO1ANTHRACENYL)4HEXYLBENZAMIDE
STK049365
ZINC000008398421
ZINC08398421
ZINC8398421

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.