Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)amino]-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)propan-1-one
Catalog ID
STK623202
SMILES O=C(N1CC2(CC1CC(C2)(C)C)C)CCNc1nc(Cl)nc2c1[nH]cn2
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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 C18H25ClN6O MW 376.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25ClN6O/c1-17(2)6-11-7-18(3,8-17)9-25(11)12(26)4-5-20-14-13-15(22-10-21-13)24-16(19)23-14/h10-11H,4-9H2,1-3H3,(H2,20,21,22,23,24)InChIKey
UKCUGEGERBYXJZ-UHFFFAOYSA-NSynonyms
929867-93-63((2chloro7Hpurin6yl)amino)1(133trimethyl6azabicyclo(321)oct6yl)propan1one
3((2chloro7Hpurin6yl)amino)1(335trimethyl7azabicyclo(321)octan7yl)propan1one
3((2chloro9Hpurin6yl)amino)1(133trimethyl6azabicyclo(321)octan6yl)propan1one
929867936
CC1(CC2CC(C1)(CN2C(=O)CCNC3=NC(=NC4=C3NC=N4)Cl)C)C
InChI=1SC18H25ClN6Oc117(2)611718(3817)925(11)12(26)4520141315(22102113)2416(19)2314h1011H49H213H3(H22021222324)
MFCD09796819
O=C(N1CC2(CC1CC(C2)(C)C)C)CCNc1nc(Cl)nc2c1(nH)cn2
O=C(N1CC2(CC1CC(C2)(C)C)C)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000101477578
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