Vitas-M small molecule compound
5-[4-(benzyloxy)benzyl]-1,3-dimethyl-5-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK013486
SMILES O=C1N(C)C(=O)C(C(=O)N1C)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccc(cc1)OCc1ccccc1
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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 C32H34N4O5 MW 554.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N4O5/c1-33-29(38)32(30(39)34(2)31(33)40,16-22-11-13-26(14-12-22)41-20-23-7-4-3-5-8-23)21-35-17-24-15-25(19-35)27-9-6-10-28(37)36(27)18-24/h3-14,24-25H,15-21H2,1-2H3/t24-,25+/m0/s1InChIKey
UVIVOVUPOFIBTL-LOSJGSFVSA-NSynonyms
5(4(benzyloxy)benzyl)13dimethyl5(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)pyrimidine246(1H3H5H)trione
5(4(benzyloxy)benzyl)13dimethyl5(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)pyrimidine246(1H3H5H)trione
CN1C(=O)C(C(=O)N(C1=O)C)(CC2=CC=C(C=C2)OCC3=CC=CC=C3)CN4CC5CC(C4)C6=CC=CC(=O)N6C5
InChI=1SC32H34N4O5c13329(38)32(30(39)34(2)31(33)401622111326(141222)4120237435823)213517241525(1935)27961028(37)36(27)1824h3142425H1521H212H3t2425+m1s1
MFCD13368278
O=C1N(C)C(=O)C(C(=O)N1C)(CN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cc1ccc(cc1)OCc1ccccc1
STK013486
ZINC000070665731
ZINC70665731
Check stock
See real-time availability and sample size for STK013486 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.