Vitas-M small molecule compound
5-(2,3-dimethoxybenzyl)-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
STK099602
SMILES COc1cccc(c1OC)CC1(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)C(=O)N(C)C(=O)N(C1=O)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 C27H32N4O6 MW 508.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O6/c1-28-24(33)27(25(34)29(2)26(28)35,12-18-7-5-9-21(36-3)23(18)37-4)16-30-13-17-11-19(15-30)20-8-6-10-22(32)31(20)14-17/h5-10,17,19H,11-16H2,1-4H3/t17-,19+/m0/s1InChIKey
RMFKOAZRDBNMJJ-PKOBYXMFSA-NSynonyms
5(23dimethoxybenzyl)13dimethyl5(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)pyrimidine246(1H3H5H)trione
5(23dimethoxybenzyl)13dimethyl5(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)pyrimidine246(1H3H5H)trione
CN1C(=O)C(C(=O)N(C1=O)C)(CC2=C(C(=CC=C2)OC)OC)CN3CC4CC(C3)C5=CC=CC(=O)N5C4
COc1cccc(c1OC)CC1(CN2C(C@@H)3C(C@H)(C2)c2n(C3)c(=O)ccc2)C(=O)N(C)C(=O)N(C1=O)C
COc1cccc(c1OC)CC1(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)C(=O)N(C)C(=O)N(C1=O)C
InChI=1SC27H32N4O6c12824(33)27(25(34)29(2)26(28)35121875921(363)23(18)374)163013171119(1530)20861022(32)31(20)1417h5101719H1116H214H3t1719+m1s1
MFCD13368406
STK099602
ZINC000019702895
ZINC19702895
Check stock
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Check stock on Vitas-MAvailable files
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