2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine

C21H13N7S — CID 137311638

IUPAC2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
SMILESc1cc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)cncc5[nH]4)c3n2)ccn1
InChIInChI=1S/C21H13N7S/c1-2-16-19(24-15(1)12-3-6-22-7-4-12)20(28-27-16)21-25-17-10-23-9-14(18(17)26-21)13-5-8-29-11-13/h1-11H,(H,25,26)(H,27,28)
InChIKeyNKQXFGMMRFKURN-UHFFFAOYSA-N
MW395.45 g/mol
LogP4.69
Rot. Bonds3

About 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine

2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine (PubChem CID 137311638) has the molecular formula C21H13N7S and a molecular weight of 395.45 g/mol. Its IUPAC name is 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
PubChem CID137311638
Molecular FormulaC21H13N7S
Molecular Weight395.45 g/mol
Exact Mass395.10
IUPAC Name2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
SMILESc1cc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)cncc5[nH]4)c3n2)ccn1
InChIInChI=1S/C21H13N7S/c1-2-16-19(24-15(1)12-3-6-22-7-4-12)20(28-27-16)21-25-17-10-23-9-14(18(17)26-21)13-5-8-29-11-13/h1-11H,(H,25,26)(H,27,28)
InChIKeyNKQXFGMMRFKURN-UHFFFAOYSA-N
XLogP4.69
TPSA96.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.45
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 137110531
2-[5-(1H-pyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 137109924
5-pyridin-4-yl-3-(7-pyridin-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137110315
5-pyridin-3-yl-3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 139424393
3-fluoro-5-[2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-3H-imidazo[4,5-c]pyridin-7-yl]phenol
CID 137110240
3-(7-cyclopenta-1,4-dien-1-yl-3H-imidazo[4,5-c]pyridin-2-yl)-5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridine
CID 145248869
N-[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]cyclohexanecarboxamide
CID 137110132
5-(5-methoxy-3-pyridinyl)-3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 139424512
5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-ol
CID 137311743
2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 136947287
5-(1-methylpyrazol-4-yl)-3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137109356
5-[3-(4-thiophen-3-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-ol
CID 137112581

Frequently Asked Questions

What is the IUPAC name of 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine (CID 137311638) is 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine is c1cc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)cncc5[nH]4)c3n2)ccn1.
What is the InChIKey of 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?
The InChIKey is NKQXFGMMRFKURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13N7S/c1-2-16-19(24-15(1)12-3-6-22-7-4-12)20(28-27-16)21-25-17-10-23-9-14(18(17)26-21)13-5-8-29-11-13/h1-11H,(H,25,26)(H,27,28).
What are the key properties of 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?
2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine has a molecular weight of 395.45 g/mol, XLogP of 4.69, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 137311638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).