Vitas-M small molecule compound

methyl N-({trans-4-[(2-hydroxy-4-oxoquinazolin-3(4H)-yl)methyl]cyclohexyl}carbonyl)-L-alaninate

Catalog ID
STK649388
SMILES COC(=O)[C@@H](NC(=O)[C@@H]1CC[C@H](CC1)Cn1c(O)nc2c(c1=O)cccc2)C

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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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-12(19(26)28-2)21-17(24)14-9-7-13(8-10-14)11-23-18(25)15-5-3-4-6-16(15)22-20(23)27/h3-6,12-14H,7-11H2,1-2H3,(H,21,24)(H,22,27)/t12-,13-,14-/m0/s1
InChIKey
LAEIYMPGJPIZDI-IHRRRGAJSA-N
Synonyms

COC(=O)(C@@H)(NC(=O)(C@@H)1CC(C@H)(CC1)Cn1c(O)nc2c(c1=O)cccc2)C
methylN((trans4((2hydroxy4oxoquinazolin3(4H)yl)methyl)cyclohexyl)carbonyl)Lalaninate
MFCD18165255
ZINC000245255699

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Available files

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