Vitas-M small molecule compound

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

Catalog ID
STK661206
SMILES COC(=O)CCNC(=O)[C@@H]1CC[C@H](CC1)Cn1c(O)nc2c(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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-28-17(24)10-11-21-18(25)14-8-6-13(7-9-14)12-23-19(26)15-4-2-3-5-16(15)22-20(23)27/h2-5,13-14H,6-12H2,1H3,(H,21,25)(H,22,27)/t13-,14-
InChIKey
TZUWHUGSJLLCQC-HDJSIYSDSA-N
Synonyms

COC(=O)CCNC(=O)(C@@H)1CC(C@H)(CC1)Cn1c(O)nc2c(c1=O)cccc2
methylN((trans4((2hydroxy4oxoquinazolin3(4H)yl)methyl)cyclohexyl)carbonyl)betaalaninate
MFCD18169330
ZINC000245256827

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Available files

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