Vitas-M small molecule compound
trans-4-({[(2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]amino}methyl)cyclohexanecarboxylic acid
Catalog ID
STK577569
SMILES OC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2
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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 C27H28N4O5 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O5/c32-24(29-14-16-9-11-17(12-10-16)26(34)35)23(13-18-15-28-21-7-3-1-5-19(18)21)31-25(33)20-6-2-4-8-22(20)30-27(31)36/h1-8,15-17,23,28H,9-14H2,(H,29,32)(H,30,36)(H,34,35)/t16-,17-,23-/m1/s1InChIKey
ZIMQAIQBTNFMDR-SEPYTNNBSA-NSynonyms
(1S4r)4(((S)2(24dioxo12dihydroquinazolin3(4H)yl)3(1Hindol3yl)propanamido)methyl)cyclohexanecarboxylicacid
MFCD07638008
OC(=O)(C@@H)1CC(C@H)(CC1)CNC(=O)(C@H)(n1c(=O)(nH)c2c(c1=O)cccc2)Cc1c(nH)c2c1cccc2
OC(=O)(C@@H)1CCC(CC1)CNC(=O)(C@@H)(n1c(=O)(nH)c2c(c1=O)cccc2)Cc1c(nH)c2c1cccc2
trans4((((2R)2(24dioxo14dihydroquinazolin3(2H)yl)3(1Hindol3yl)propanoyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000247449600
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