Vitas-M small molecule compound

N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-leucyl-L-leucine

Catalog ID
STL007429
SMILES CC(C[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1)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 C29H36N4O6 MW 536.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N4O6/c1-17(2)14-22(25(34)31-23(28(37)38)15-18(3)4)30-26(35)24(16-19-10-6-5-7-11-19)33-27(36)20-12-8-9-13-21(20)32-29(33)39/h5-13,17-18,22-24H,14-16H2,1-4H3,(H,30,35)(H,31,34)(H,32,39)(H,37,38)/t22-,23-,24-/m0/s1
InChIKey
QHVMQTKFXOUXCO-HJOGWXRNSA-N
Synonyms
1173660-77-9
(2S)2(((2S)2(((2S)2(24dioxo1Hquinazolin3yl)3phenylpropanoyl)amino)4methylpentanoyl)amino)4methylpentanoicacid
(S)2((S)2((S)2(24dioxo12dihydroquinazolin3(4H)yl)3phenylpropanamido)4methylpentanamido)4methylpentanoicacid
1173660779
CC(C(C@@H)(C(=O)N(C@H)(C(=O)O)CC(C)C)NC(=O)(C@@H)(n1c(=O)(nH)c2c(c1=O)cccc2)Cc1ccccc1)C
CC(C)CC(C(=O)NC(CC(C)C)C(=O)O)NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3NC2=O
InChI=1SC29H36N4O6c117(2)1422(25(34)3123(28(37)38)1518(3)4)3026(35)24(1619106571119)3327(36)2012891321(20)3229(33)39h51317182224H1416H214H3(H3035)(H3134)(H3239)(H3738)t222324m0s1
MFCD06768439
N((2S)2(24DIOXO14DIHYDROQUINAZOLIN3(2H)YL)3PHENYLPROPANOYL)LLEUCYLLLEUCINE
ZINC000070701167
ZINC70701167

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Available files

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