Vitas-M small molecule compound

N,N,N',N'-tetramethyl-N-{2-[(3-methylcyclohexyl)oxy]-2-oxoethyl}-N'-{2-[5-methyl-2-(propan-2-yl)cyclohexyl]-2-oxoethyl}decane-1,10-diaminium

Catalog ID
STL058194
SMILES CC1CCCC(C1)OC(=O)C[N+](CCCCCCCCCC[N+](CC(=O)C1CC(C)CCC1C(C)C)(C)C)(C)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 C35H68N2O3 MW 564.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H68N2O3/c1-28(2)32-21-20-30(4)25-33(32)34(38)26-36(5,6)22-15-13-11-9-10-12-14-16-23-37(7,8)27-35(39)40-31-19-17-18-29(3)24-31/h28-33H,9-27H2,1-8H3/q+2
InChIKey
ZNMZQXDUPKWJBV-UHFFFAOYSA-N
Synonyms
1301706-96-6
10(dimethyl(2(3methylcyclohexyl)oxy2oxoethyl)azaniumyl)decyldimethyl(2(5methyl2propan2ylcyclohexyl)2oxoethyl)azanium
1301706966
CC1CCCC(C1)OC(=O)C(N+)(C)(C)CCCCCCCCCC(N+)(C)(C)CC(=O)C2CC(CCC2C(C)C)C
CC1CCCC(C1)OC(=O)C(N+)(CCCCCCCCCC(N+)(CC(=O)C1CC(C)CCC1C(C)C)(C)C)(C)C
CC1CCCC(C1)OC(=O)C(N+)(CCCCCCCCCC(N+)(CC(=O)C1CC(C)CCC1C(C)C)(C)C)(C)C(Cl)(Cl)
InChI=1SC35H68N2O3c128(2)32212030(4)2533(32)34(38)2636(56)221513119101214162337(78)2735(39)403119171829(3)2431h2833H927H218H3q+2
N1(2(2isopropyl5methylcyclohexyl)2oxoethyl)N1N1N10N10tetramethylN10(2((3methylcyclohexyl)oxy)2oxoethyl)decane110diaminiumchloride
NNNNtetramethylN(2((3methylcyclohexyl)oxy)2oxoethyl)N(2(5methyl2(propan2yl)cyclohexyl)2oxoethyl)decane110diaminium
ZINC000036522112
ZINC000245247951

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Available files

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