4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine

C22H14FN7OS — CID 137255076

About 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine

4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine (PubChem CID 137255076) has the molecular formula C22H14FN7OS and a molecular weight of 443.47 g/mol. Its IUPAC name is 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine
• PubChem CID: 137255076
• Molecular Formula: C22H14FN7OS
• Molecular Weight: 443.47 g/mol
• Exact Mass: 443.10
• IUPAC Name: 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine
• SMILES: COc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccc(F)s6)nccc5[nH]4)c3c2)n1
• InChI: InChI=1S/C22H14FN7OS/c1-31-18-10-24-9-15(26-18)11-2-3-13-12(8-11)19(30-29-13)22-27-14-6-7-25-21(20(14)28-22)16-4-5-17(23)32-16/h2-10H,1H3,(H,27,28)(H,29,30)
• InChIKey: PROSSVZFLIZYTR-UHFFFAOYSA-N
• XLogP: 4.83
• TPSA: 105.26 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	443.47
LogP ≤ 5	4.83
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?

The IUPAC name of 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine (CID 137255076) is 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?

The canonical SMILES for 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine is COc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccc(F)s6)nccc5[nH]4)c3c2)n1.

What is the InChIKey of 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?

The InChIKey is PROSSVZFLIZYTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14FN7OS/c1-31-18-10-24-9-15(26-18)11-2-3-13-12(8-11)19(30-29-13)22-27-14-6-7-25-21(20(14)28-22)16-4-5-17(23)32-16/h2-10H,1H3,(H,27,28)(H,29,30).

What are the key properties of 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?

4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine has a molecular weight of 443.47 g/mol, XLogP of 4.83, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(5-fluorothiophen-2-yl)-2-[5-(6-methoxypyrazin-2-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 137255076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).