Vitas-M small molecule compound

4-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-cyclopentylbutanamide

Catalog ID
STL131571
SMILES O=C(NC1CCCC1)CCCn1c(=O)n(CC(=O)NCCC2=CCCCC2)c2c(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 C27H36N4O4 MW 480.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N4O4/c32-24(29-21-11-4-5-12-21)15-8-18-30-26(34)22-13-6-7-14-23(22)31(27(30)35)19-25(33)28-17-16-20-9-2-1-3-10-20/h6-7,9,13-14,21H,1-5,8,10-12,15-19H2,(H,28,33)(H,29,32)
InChIKey
JDHQHKVSTRIFSR-UHFFFAOYSA-N
Synonyms
866013-74-3
4(1(2((2(CYCLOHEX1EN1YL)ETHYL)AMINO)2OXOETHYL)24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)NCYCLOPENTYLBUTANAMIDE
4(1(2((2(cyclohex1en1yl)ethyl)amino)2oxoethyl)24dioxo14dihydroquinazolin3(2H)yl)Ncyclopentylbutanamide
4(1(2((2CYCLOHEX1EN1YLETHYL)AMINO)2OXOETHYL)24DIOXO14DIHYDROQUINAZOLIN3(2H)YL)NCYCLOPENTYLBUTANAMIDE
4(1(2(2(CYCLOHEXEN1YL)ETHYLAMINO)2OXOETHYL)24DIOXOQUINAZOLIN3YL)NCYCLOPENTYLBUTANAMIDE
866013743
C1CCC(=CC1)CCNC(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)CCCC(=O)NC4CCCC4
InChI=1SC27H36N4O4c3224(292111451221)158183026(34)2213671423(22)31(27(30)35)1925(33)2817162092131020h679131421H15810121519H2(H2833)(H2932)
MFCD04445127
ZINC000004110623
ZINC04110623
ZINC4110623

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Available files

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