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

C21H13N7S — CID 136947287

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

2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine (PubChem CID 136947287) has the molecular formula C21H13N7S and a molecular weight of 395.45 g/mol. Its IUPAC name is 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
• PubChem CID: 136947287
• Molecular Formula: C21H13N7S
• Molecular Weight: 395.45 g/mol
• Exact Mass: 395.10
• IUPAC Name: 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
• SMILES: c1ccc(-c2cc3c(-c4nc5c(-c6ccsc6)cncc5[nH]4)n[nH]c3cn2)nc1
• InChI: InChI=1S/C21H13N7S/c1-2-5-23-15(3-1)16-7-13-17(10-24-16)27-28-20(13)21-25-18-9-22-8-14(19(18)26-21)12-4-6-29-11-12/h1-11H,(H,25,26)(H,27,28)
• InChIKey: GMNWNOYSHCHMHV-UHFFFAOYSA-N
• XLogP: 4.69
• TPSA: 96.03 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	395.45
LogP ≤ 5	4.69
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?

The IUPAC name of 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) is 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?

The canonical SMILES for 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine is c1ccc(-c2cc3c(-c4nc5c(-c6ccsc6)cncc5[nH]4)n[nH]c3cn2)nc1.

What is the InChIKey of 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?

The InChIKey is GMNWNOYSHCHMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13N7S/c1-2-5-23-15(3-1)16-7-13-17(10-24-16)27-28-20(13)21-25-18-9-22-8-14(19(18)26-21)12-4-6-29-11-12/h1-11H,(H,25,26)(H,27,28).

What are the key properties of 2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine?

2-(5-pyridin-2-yl-1H-pyrazolo[3,4-c]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-2-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 136947287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).