3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide

C83H124ClI3N18O6S6 — CID 165074574

IUPAC3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide
SMILESCI.Clc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])O.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1ccc[n+](C)c1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1C1=CCCN(C)C1.[2H]C([2H])([2H])N1CCC=C(c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)C1.[2H]C([2H])([2H])[n+]1cccc(-c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)c1.[I-].[I-]
InChIInChI=1S/2C14H23N3OS.2C14H20N3OS.C13H17N3OS.C7H4ClN3S.C6H14O.CH3I.2HI/c4*1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12;1-2-3-4-5-9-17-13-12(15-18-16-13)11-7-6-8-14-10-11;8-7-6(10-12-11-7)5-2-1-3-9-4-5;1-2-3-4-5-6-7;1-2;;/h2*8H,3-7,9-11H2,1-2H3;2*7-9,11H,3-6,10H2,1-2H3;6-8,10H,2-5,9H2,1H3;1-4H;7H,2-6H2,1H3;1H3;2*1H/q;;2*+1;;;;;;/p-2/i2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D2,3D2,4D2,5D2,9D2;;2D2,3D2,4D2,5D2,6D2;;;
InChIKeyBCXSSZORWXSRTJ-BYACHLKRSA-L
MW2144.99 g/mol
LogP14.84
Rot. Bonds42

About 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide

3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide (PubChem CID 165074574) has the molecular formula C83H124ClI3N18O6S6 and a molecular weight of 2144.99 g/mol. Its IUPAC name is 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide.

Molecular Properties

Compound Name3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide
PubChem CID165074574
Molecular FormulaC83H124ClI3N18O6S6
Molecular Weight2144.99 g/mol
Exact Mass2142.92
IUPAC Name3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide
SMILESCI.Clc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])O.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1ccc[n+](C)c1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1C1=CCCN(C)C1.[2H]C([2H])([2H])N1CCC=C(c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)C1.[2H]C([2H])([2H])[n+]1cccc(-c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)c1.[I-].[I-]
InChIInChI=1S/2C14H23N3OS.2C14H20N3OS.C13H17N3OS.C7H4ClN3S.C6H14O.CH3I.2HI/c4*1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12;1-2-3-4-5-9-17-13-12(15-18-16-13)11-7-6-8-14-10-11;8-7-6(10-12-11-7)5-2-1-3-9-4-5;1-2-3-4-5-6-7;1-2;;/h2*8H,3-7,9-11H2,1-2H3;2*7-9,11H,3-6,10H2,1-2H3;6-8,10H,2-5,9H2,1H3;1-4H;7H,2-6H2,1H3;1H3;2*1H/q;;2*+1;;;;;;/p-2/i2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D2,3D2,4D2,5D2,9D2;;2D2,3D2,4D2,5D2,6D2;;;
InChIKeyBCXSSZORWXSRTJ-BYACHLKRSA-L
XLogP14.84
TPSA261.08 Ų
H-Bond Donors1
H-Bond Acceptors28
Rotatable Bonds42
Heavy Atoms117
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.99
LogP ≤ 514.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1028

Analyze 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide?
The IUPAC name of 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide (CID 165074574) is 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide.
What is the SMILES notation for 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide?
The canonical SMILES for 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide is CI.Clc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])O.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1ccc[n+](C)c1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1-c1cccnc1.[2H]C([2H])(C)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1nsnc1C1=CCCN(C)C1.[2H]C([2H])([2H])N1CCC=C(c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)C1.[2H]C([2H])([2H])[n+]1cccc(-c2nsnc2OC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C)c1.[I-].[I-].
What is the InChIKey of 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide?
The InChIKey is BCXSSZORWXSRTJ-BYACHLKRSA-L. The full InChI is InChI=1S/2C14H23N3OS.2C14H20N3OS.C13H17N3OS.C7H4ClN3S.C6H14O.CH3I.2HI/c4*1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12;1-2-3-4-5-9-17-13-12(15-18-16-13)11-7-6-8-14-10-11;8-7-6(10-12-11-7)5-2-1-3-9-4-5;1-2-3-4-5-6-7;1-2;;/h2*8H,3-7,9-11H2,1-2H3;2*7-9,11H,3-6,10H2,1-2H3;6-8,10H,2-5,9H2,1H3;1-4H;7H,2-6H2,1H3;1H3;2*1H/q;;2*+1;;;;;;/p-2/i2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D3,3D2,4D2,5D2,6D2,10D2;3D2,4D2,5D2,6D2,10D2;2D2,3D2,4D2,5D2,9D2;;2D2,3D2,4D2,5D2,6D2;;;.
What are the key properties of 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide?
3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide has a molecular weight of 2144.99 g/mol, XLogP of 14.84, 42 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-pyridin-3-yl-1,2,5-thiadiazole;1,1,2,2,3,3,4,4,5,5-decadeuteriohexan-1-ol;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-pyridin-3-yl-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)-3,6-dihydro-2H-pyridin-5-yl]-1,2,5-thiadiazole;3-(1,1,2,2,3,3,4,4,5,5-decadeuteriohexoxy)-4-[1-(trideuteriomethyl)pyridin-1-ium-3-yl]-1,2,5-thiadiazole;iodomethane;diiodide is sourced from PubChem (CID 165074574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).