Vitas-M small molecule compound

N-{[4-({[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)acetyl]amino}methyl)cyclohexyl]carbonyl}isoleucine

Catalog ID
STL058166
SMILES CCC(C(C(=O)O)NC(=O)C1CCC(CC1)CNC(=O)Cn1c(=O)[nH]c2c(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 C24H32N4O6 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N4O6/c1-3-14(2)20(23(32)33)27-21(30)16-10-8-15(9-11-16)12-25-19(29)13-28-22(31)17-6-4-5-7-18(17)26-24(28)34/h4-7,14-16,20H,3,8-13H2,1-2H3,(H,25,29)(H,26,34)(H,27,30)(H,32,33)
InChIKey
ZYLAIOQXVSYWNG-UHFFFAOYSA-N
Synonyms

(2S3R)2((1r4S)4((2(24dioxo12dihydroquinazolin3(4H)yl)acetamido)methyl)cyclohexanecarboxamido)3methylpentanoicacid
2((4(((2(24dioxo1Hquinazolin3yl)acetyl)amino)methyl)cyclohexanecarbonyl)amino)3methylpentanoicacid
CCC((C@@H)(C(=O)O)NC(=O)(C@@H)1CCC(CC1)CNC(=O)Cn1c(=O)(nH)c2c(c1=O)cccc2)C
CCC(C(C(=O)O)NC(=O)C1CCC(CC1)CNC(=O)Cn1c(=O)(nH)c2c(c1=O)cccc2)C
CCC(C)C(C(=O)O)NC(=O)C1CCC(CC1)CNC(=O)CN2C(=O)C3=CC=CC=C3NC2=O
InChI=1SC24H32N4O6c1314(2)20(23(32)33)2721(30)1610815(91116)122519(29)132822(31)17645718(17)2624(28)34h47141620H3813H212H3(H2529)(H2634)(H2730)(H3233)
MFCD07640078
N((4((((24dioxo14dihydroquinazolin3(2H)yl)acetyl)amino)methyl)cyclohexyl)carbonyl)isoleucine
ZINC000009129346
ZINC000015971341

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Available files

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