Vitas-M small molecule compound
(1S,5R)-3-[6-(pyrimidin-2-ylamino)hexanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL545104
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CCCCCNc1ncccn1
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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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c27-19(7-2-1-3-9-22-21-23-10-5-11-24-21)25-13-16-12-17(15-25)18-6-4-8-20(28)26(18)14-16/h4-6,8,10-11,16-17H,1-3,7,9,12-15H2,(H,22,23,24)/t16-,17+/m0/s1InChIKey
FEKOMWURMCXBCM-DLBZAZTESA-NSynonyms
(1R5S)3(6(pyrimidin2ylamino)hexanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(6(pyrimidin2ylamino)hexanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC21H27N5O2c2719(72139222123105112421)2513161217(1525)1864820(28)26(18)1416h46810111617H13791215H2(H222324)t1617+m0s1
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CCCCCNc1ncccn1
ZINC000225415465
Check stock
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