2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole

C18H16N6O3S2 — CID 146933694

IUPAC2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
SMILESCOc1cc(OCc2csc(C)n2)c2cc(-c3cn4nc(OC)sc4n3)nn2c1
InChIInChI=1S/C18H16N6O3S2/c1-10-19-11(9-28-10)8-27-16-4-12(25-2)6-23-15(16)5-13(21-23)14-7-24-17(20-14)29-18(22-24)26-3/h4-7,9H,8H2,1-3H3
InChIKeyAFMWYFJSBVKUNE-UHFFFAOYSA-N
MW428.50 g/mol
LogP3.47
Rot. Bonds6

About 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole

2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole (PubChem CID 146933694) has the molecular formula C18H16N6O3S2 and a molecular weight of 428.50 g/mol. Its IUPAC name is 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole.

Molecular Properties

Compound Name2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
PubChem CID146933694
Molecular FormulaC18H16N6O3S2
Molecular Weight428.50 g/mol
Exact Mass428.07
IUPAC Name2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
SMILESCOc1cc(OCc2csc(C)n2)c2cc(-c3cn4nc(OC)sc4n3)nn2c1
InChIInChI=1S/C18H16N6O3S2/c1-10-19-11(9-28-10)8-27-16-4-12(25-2)6-23-15(16)5-13(21-23)14-7-24-17(20-14)29-18(22-24)26-3/h4-7,9H,8H2,1-3H3
InChIKeyAFMWYFJSBVKUNE-UHFFFAOYSA-N
XLogP3.47
TPSA88.07 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.50
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole with MolForge

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Related Compounds

6-(4-butoxy-6-methoxypyrazolo[1,5-a]pyridin-2-yl)-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole
CID 153363289
2-[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)pyrazolo[1,5-a]pyridin-4-yl]oxy-N-phenylacetamide
CID 147673011
2-bromo-6-(4,6-dimethoxypyrazolo[1,5-a]pyridin-2-yl)imidazo[2,1-b][1,3,4]thiadiazole
CID 153363294
6-[4-[[2-(2-fluoro-3-pyridinyl)-1,3-thiazol-4-yl]methoxy]-6-methoxy-1-benzofuran-2-yl]-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole
CID 129286902
2-methoxy-6-[6-methoxy-4-[[2-[(2R)-2-methylpyrrolidin-1-yl]-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
CID 170067964
6-(4,6-dimethoxy-3-methyl-1-benzofuran-2-yl)-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole
CID 118068438
6-[6-methoxy-4-[[2-(1-methoxycyclohexyl)-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 130375623
2-methoxy-6-[6-methoxy-4-[[2-[1-(trifluoromethylsulfanyl)piperidin-4-yl]-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
CID 130179506
N-[3-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]phenyl]-N,2-dimethyl-1,3-thiazole-4-carboxamide
CID 158080578
N-(aminomethyl)-4-[4-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]-1,3-thiazol-2-yl]-N-methylbenzamide
CID 130179778
2-methoxy-6-[6-methoxy-4-[(3-methylphenyl)methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
CID 118068378
6-(4,6-dimethoxy-1-benzofuran-2-yl)-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole
CID 118068442

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole?
The IUPAC name of 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole (CID 146933694) is 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole.
What is the SMILES notation for 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole?
The canonical SMILES for 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole is COc1cc(OCc2csc(C)n2)c2cc(-c3cn4nc(OC)sc4n3)nn2c1.
What is the InChIKey of 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole?
The InChIKey is AFMWYFJSBVKUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O3S2/c1-10-19-11(9-28-10)8-27-16-4-12(25-2)6-23-15(16)5-13(21-23)14-7-24-17(20-14)29-18(22-24)26-3/h4-7,9H,8H2,1-3H3.
What are the key properties of 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole?
2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole has a molecular weight of 428.50 g/mol, XLogP of 3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[6-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyrazolo[1,5-a]pyridin-2-yl]imidazo[2,1-b][1,3,4]thiadiazole is sourced from PubChem (CID 146933694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).