N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide

C24H18N4O2S — CID 52936960

IUPACN-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide
SMILESO=S(=O)(Nc1cncc(-c2ccc3ncc(-c4ccccc4)n3c2)c1)c1ccccc1
InChIInChI=1S/C24H18N4O2S/c29-31(30,22-9-5-2-6-10-22)27-21-13-20(14-25-15-21)19-11-12-24-26-16-23(28(24)17-19)18-7-3-1-4-8-18/h1-17,27H
InChIKeyCTKAOJMAEUTJDY-UHFFFAOYSA-N
MW426.50 g/mol
LogP4.86
Rot. Bonds5

About N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide

N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide (PubChem CID 52936960) has the molecular formula C24H18N4O2S and a molecular weight of 426.50 g/mol. Its IUPAC name is N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide
PubChem CID52936960
Molecular FormulaC24H18N4O2S
Molecular Weight426.50 g/mol
Exact Mass426.12
IUPAC NameN-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide
SMILESO=S(=O)(Nc1cncc(-c2ccc3ncc(-c4ccccc4)n3c2)c1)c1ccccc1
InChIInChI=1S/C24H18N4O2S/c29-31(30,22-9-5-2-6-10-22)27-21-13-20(14-25-15-21)19-11-12-24-26-16-23(28(24)17-19)18-7-3-1-4-8-18/h1-17,27H
InChIKeyCTKAOJMAEUTJDY-UHFFFAOYSA-N
XLogP4.86
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.50
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide?
The IUPAC name of N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide (CID 52936960) is N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide.
What is the SMILES notation for N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide?
The canonical SMILES for N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide is O=S(=O)(Nc1cncc(-c2ccc3ncc(-c4ccccc4)n3c2)c1)c1ccccc1.
What is the InChIKey of N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide?
The InChIKey is CTKAOJMAEUTJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N4O2S/c29-31(30,22-9-5-2-6-10-22)27-21-13-20(14-25-15-21)19-11-12-24-26-16-23(28(24)17-19)18-7-3-1-4-8-18/h1-17,27H.
What are the key properties of N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide?
N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide has a molecular weight of 426.50 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-phenylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 52936960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).