6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide

C23H22N4O7 — CID 155558819

IUPAC6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c([nH]c(=O)n3-c3cc(OC)c(OC)c(OC)c3)c(C(N)=O)n2)cc1O
InChIInChI=1S/C23H22N4O7/c1-31-16-6-5-11(7-15(16)28)13-10-14-19(20(25-13)22(24)29)26-23(30)27(14)12-8-17(32-2)21(34-4)18(9-12)33-3/h5-10,28H,1-4H3,(H2,24,29)(H,26,30)
InChIKeyWUZIEGHVPAZRFN-UHFFFAOYSA-N
MW466.45 g/mol
LogP2.22
Rot. Bonds7

About 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide

6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide (PubChem CID 155558819) has the molecular formula C23H22N4O7 and a molecular weight of 466.45 g/mol. Its IUPAC name is 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide
PubChem CID155558819
Molecular FormulaC23H22N4O7
Molecular Weight466.45 g/mol
Exact Mass466.15
IUPAC Name6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c([nH]c(=O)n3-c3cc(OC)c(OC)c(OC)c3)c(C(N)=O)n2)cc1O
InChIInChI=1S/C23H22N4O7/c1-31-16-6-5-11(7-15(16)28)13-10-14-19(20(25-13)22(24)29)26-23(30)27(14)12-8-17(32-2)21(34-4)18(9-12)33-3/h5-10,28H,1-4H3,(H2,24,29)(H,26,30)
InChIKeyWUZIEGHVPAZRFN-UHFFFAOYSA-N
XLogP2.22
TPSA150.92 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.45
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide?
The IUPAC name of 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide (CID 155558819) is 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide.
What is the SMILES notation for 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide?
The canonical SMILES for 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide is COc1ccc(-c2cc3c([nH]c(=O)n3-c3cc(OC)c(OC)c(OC)c3)c(C(N)=O)n2)cc1O.
What is the InChIKey of 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide?
The InChIKey is WUZIEGHVPAZRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O7/c1-31-16-6-5-11(7-15(16)28)13-10-14-19(20(25-13)22(24)29)26-23(30)27(14)12-8-17(32-2)21(34-4)18(9-12)33-3/h5-10,28H,1-4H3,(H2,24,29)(H,26,30).
What are the key properties of 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide?
6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide has a molecular weight of 466.45 g/mol, XLogP of 2.22, 7 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxy-4-methoxyphenyl)-2-oxo-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridine-4-carboxamide is sourced from PubChem (CID 155558819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).