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

C34H17N7O2S — CID 137205678

IUPAC4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc2c(c1)oc1c(-c3ncc(-c4cnc(-c5ccnc6c5oc5ccccc56)c5scnc45)c4[nH]cnc34)ccnc12
InChIInChI=1S/C34H17N7O2S/c1-3-7-23-17(5-1)27-32(42-23)19(9-11-35-27)25-31-26(39-15-40-31)21(13-37-25)22-14-38-29(34-30(22)41-16-44-34)20-10-12-36-28-18-6-2-4-8-24(18)43-33(20)28/h1-16H,(H,39,40)
InChIKeyFWCZIFGIIDAPCG-UHFFFAOYSA-N
MW587.62 g/mol
LogP8.55
Rot. Bonds3

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

4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine (PubChem CID 137205678) has the molecular formula C34H17N7O2S and a molecular weight of 587.62 g/mol. Its IUPAC name is 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine
PubChem CID137205678
Molecular FormulaC34H17N7O2S
Molecular Weight587.62 g/mol
Exact Mass587.12
IUPAC Name4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc2c(c1)oc1c(-c3ncc(-c4cnc(-c5ccnc6c5oc5ccccc56)c5scnc45)c4[nH]cnc34)ccnc12
InChIInChI=1S/C34H17N7O2S/c1-3-7-23-17(5-1)27-32(42-23)19(9-11-35-27)25-31-26(39-15-40-31)21(13-37-25)22-14-38-29(34-30(22)41-16-44-34)20-10-12-36-28-18-6-2-4-8-24(18)43-33(20)28/h1-16H,(H,39,40)
InChIKeyFWCZIFGIIDAPCG-UHFFFAOYSA-N
XLogP8.55
TPSA119.41 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500587.62
LogP ≤ 58.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine (CID 137205678) is 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine is c1ccc2c(c1)oc1c(-c3ncc(-c4cnc(-c5ccnc6c5oc5ccccc56)c5scnc45)c4[nH]cnc34)ccnc12.
What is the InChIKey of 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine?
The InChIKey is FWCZIFGIIDAPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H17N7O2S/c1-3-7-23-17(5-1)27-32(42-23)19(9-11-35-27)25-31-26(39-15-40-31)21(13-37-25)22-14-38-29(34-30(22)41-16-44-34)20-10-12-36-28-18-6-2-4-8-24(18)43-33(20)28/h1-16H,(H,39,40).
What are the key properties of 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine?
4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine has a molecular weight of 587.62 g/mol, XLogP of 8.55, 3 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-[4-([1]benzofuro[3,2-b]pyridin-4-yl)-1H-imidazo[4,5-c]pyridin-7-yl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 137205678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).