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1-cyclohexyl-5-(4-methoxybenzyl)-5-{[(1R)-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
STL525993
SMILES COc1ccc(cc1)CC1(CN2CC3C[C@@H](C2)c2n(C3)c(=O)ccc2)C(=O)NC(=O)N(C1=O)C1CCCCC1

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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 C30H36N4O5 MW 532.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N4O5/c1-39-24-12-10-20(11-13-24)15-30(27(36)31-29(38)34(28(30)37)23-6-3-2-4-7-23)19-32-16-21-14-22(18-32)25-8-5-9-26(35)33(25)17-21/h5,8-13,21-23H,2-4,6-7,14-19H2,1H3,(H,31,36,38)/t21?,22-,30?/m1/s1
InChIKey
CJAGOLUMLQZUOM-QTYVGJCJSA-N
Synonyms
956956-37-9
16396919
1cyclohexyl5((4methoxyphenyl)methyl)5(((1~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)13diazinane246trione
1cyclohexyl5(4methoxybenzyl)5(((1R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)pyrimidine246(1H3H5H)trione
1cyclohexyl5(4methoxybenzyl)5(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)pyrimidine246(1H3H5H)trione
956956379
COc1ccc(cc1)CC1(CN2C(C@@H)3C(C@H)(C2)c2n(C3)c(=O)ccc2)C(=O)NC(=O)N(C1=O)C1CCCCC1
InChI=1SC30H36N4O5c13924121020(111324)1530(27(36)3129(38)34(28(30)37)236324723)193216211422(1832)2585926(35)33(25)1721h58132123H24671419H21H3(H313638)t21?2230?m1s1
MFCD02184363
ZINC000002119102
ZINC000002119104

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Available files

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