Vitas-M small molecule compound

ethyl 2-[({trans-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexyl}carbonyl)amino]benzoate

Catalog ID
STK717075
SMILES CCOC(=O)c1ccccc1NC(=O)[C@@H]1CC[C@H](CC1)Cn1cnc2c(c1=O)cccc2

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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-2-32-25(31)20-8-4-6-10-22(20)27-23(29)18-13-11-17(12-14-18)15-28-16-26-21-9-5-3-7-19(21)24(28)30/h3-10,16-18H,2,11-15H2,1H3,(H,27,29)/t17-,18-
InChIKey
GHWZERDUGIUPIR-IYARVYRRSA-N
Synonyms

CCOC(=O)c1ccccc1NC(=O)(C@@H)1CC(C@H)(CC1)Cn1cnc2c(c1=O)cccc2
CCOC(=O)c1ccccc1NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2
ethyl2(((trans4((4oxoquinazolin3(4H)yl)methyl)cyclohexyl)carbonyl)amino)benzoate
ethyl2(4((4oxoquinazolin3(4H)yl)methyl)cyclohexanecarboxamido)benzoate
MFCD10040919
ZINC000238899403

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Available files

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