2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine

C42H27FN6 — CID 23391314

IUPAC2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine
SMILESFc1cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C42H27FN6/c43-32-26-30(39-46-35-19-11-23-44-41(35)48(39)37-21-9-7-17-33(37)28-13-3-1-4-14-28)25-31(27-32)40-47-36-20-12-24-45-42(36)49(40)38-22-10-8-18-34(38)29-15-5-2-6-16-29/h1-27H
InChIKeyDQVMVTVRQGTSHO-UHFFFAOYSA-N
MW634.72 g/mol
LogP9.96
Rot. Bonds6

About 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine

2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine (PubChem CID 23391314) has the molecular formula C42H27FN6 and a molecular weight of 634.72 g/mol. Its IUPAC name is 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine
PubChem CID23391314
Molecular FormulaC42H27FN6
Molecular Weight634.72 g/mol
Exact Mass634.23
IUPAC Name2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine
SMILESFc1cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C42H27FN6/c43-32-26-30(39-46-35-19-11-23-44-41(35)48(39)37-21-9-7-17-33(37)28-13-3-1-4-14-28)25-31(27-32)40-47-36-20-12-24-45-42(36)49(40)38-22-10-8-18-34(38)29-15-5-2-6-16-29/h1-27H
InChIKeyDQVMVTVRQGTSHO-UHFFFAOYSA-N
XLogP9.96
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500634.72
LogP ≤ 59.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-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 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine?
The IUPAC name of 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine (CID 23391314) is 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine is Fc1cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)cc(-c2nc3cccnc3n2-c2ccccc2-c2ccccc2)c1.
What is the InChIKey of 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine?
The InChIKey is DQVMVTVRQGTSHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27FN6/c43-32-26-30(39-46-35-19-11-23-44-41(35)48(39)37-21-9-7-17-33(37)28-13-3-1-4-14-28)25-31(27-32)40-47-36-20-12-24-45-42(36)49(40)38-22-10-8-18-34(38)29-15-5-2-6-16-29/h1-27H.
What are the key properties of 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine?
2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine has a molecular weight of 634.72 g/mol, XLogP of 9.96, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-fluoro-5-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-phenylphenyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 23391314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).