Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(1-methyl-1H-pyrazol-4-yl)-L-leucinamide
Catalog ID
STL540584
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2cnn(c2)C)CC(C)C)NC(=O)C)cc(c1OC)OC
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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 C31H39N5O6 MW 577.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H39N5O6/c1-17(2)12-25(31(39)34-20-15-32-36(4)16-20)35-24-11-9-21-22(14-26(24)38)23(33-18(3)37)10-8-19-13-27(40-5)29(41-6)30(42-7)28(19)21/h9,11,13-17,23,25H,8,10,12H2,1-7H3,(H,33,37)(H,34,39)(H,35,38)/t23-,25-/m0/s1InChIKey
WSTFEEBICXNJGW-ZCYQVOJMSA-NSynonyms
1574391-78-8(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methyl~(N)(1methylpyrazol4yl)pentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4methylN(1methyl1Hpyrazol4yl)pentanamide
1574391788
75491922
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2cnn(c2)C)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC31H39N5O6c117(2)1225(31(39)3420153236(4)1620)35241192122(1426(24)38)23(3318(3)37)108191327(405)29(416)30(427)28(19)21h91113172325H81012H217H3(H3337)(H3439)(H3538)t2325m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hpyrazol4yl)Lleucinamide
ZINC000108449854
ZINC108449854
Check stock
See real-time availability and sample size for STL540584 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.