bis(6-phenyl-2-pyridinyl) sulfite

C22H16N2O3S — CID 58871012

IUPACbis(6-phenyl-2-pyridinyl) sulfite
SMILESO=S(Oc1cccc(-c2ccccc2)n1)Oc1cccc(-c2ccccc2)n1
InChIInChI=1S/C22H16N2O3S/c25-28(26-21-15-7-13-19(23-21)17-9-3-1-4-10-17)27-22-16-8-14-20(24-22)18-11-5-2-6-12-18/h1-16H
InChIKeyTXEDUTYZKRQQKU-UHFFFAOYSA-N
MW388.45 g/mol
LogP4.85
Rot. Bonds6

About bis(6-phenyl-2-pyridinyl) sulfite

bis(6-phenyl-2-pyridinyl) sulfite (PubChem CID 58871012) has the molecular formula C22H16N2O3S and a molecular weight of 388.45 g/mol. Its IUPAC name is bis(6-phenyl-2-pyridinyl) sulfite.

Molecular Properties

Compound Namebis(6-phenyl-2-pyridinyl) sulfite
PubChem CID58871012
Molecular FormulaC22H16N2O3S
Molecular Weight388.45 g/mol
Exact Mass388.09
IUPAC Namebis(6-phenyl-2-pyridinyl) sulfite
SMILESO=S(Oc1cccc(-c2ccccc2)n1)Oc1cccc(-c2ccccc2)n1
InChIInChI=1S/C22H16N2O3S/c25-28(26-21-15-7-13-19(23-21)17-9-3-1-4-10-17)27-22-16-8-14-20(24-22)18-11-5-2-6-12-18/h1-16H
InChIKeyTXEDUTYZKRQQKU-UHFFFAOYSA-N
XLogP4.85
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-6-phenylpyridine
CID 58166184
2-phenyl-6-prop-2-enoxypyridine
CID 3537751
2,2-dimethyl-4-[(6-phenyl-2-pyridinyl)oxy]pentanoic acid
CID 70535624
2-phenyl-6-(2,2,2-trifluoroethoxy)pyridine
CID 135043638
2-(2-ethoxyethoxy)-6-phenylpyridine
CID 70537006
3-(6-phenyl-2-pyridinyl)-6-[6-(6-phenyl-2-pyridinyl)pyridazin-3-yl]pyridazine
CID 67041293
[(6-phenyl-2-pyridinyl)amino]mercury
CID 143075087
2-benzo[d][1,3,2]benzodioxaphosphepin-6-yloxy-6-phenylpyridine
CID 140807977
2-phenyl-6-(3-pyridin-2-ylphenoxy)pyridine
CID 58871043
(1S,5R)-3-[(6-phenyl-2-pyridinyl)oxy]-8-azabicyclo[3.2.1]octane
CID 53323531
2-phenoxy-6-(6-phenoxy-2-pyridinyl)pyridine
CID 10735915
2-phenoxy-6-[4-(trifluoromethyl)phenyl]pyridine
CID 102190448

Frequently Asked Questions

What is the IUPAC name of bis(6-phenyl-2-pyridinyl) sulfite?
The IUPAC name of bis(6-phenyl-2-pyridinyl) sulfite (CID 58871012) is bis(6-phenyl-2-pyridinyl) sulfite.
What is the SMILES notation for bis(6-phenyl-2-pyridinyl) sulfite?
The canonical SMILES for bis(6-phenyl-2-pyridinyl) sulfite is O=S(Oc1cccc(-c2ccccc2)n1)Oc1cccc(-c2ccccc2)n1.
What is the InChIKey of bis(6-phenyl-2-pyridinyl) sulfite?
The InChIKey is TXEDUTYZKRQQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O3S/c25-28(26-21-15-7-13-19(23-21)17-9-3-1-4-10-17)27-22-16-8-14-20(24-22)18-11-5-2-6-12-18/h1-16H.
What are the key properties of bis(6-phenyl-2-pyridinyl) sulfite?
bis(6-phenyl-2-pyridinyl) sulfite has a molecular weight of 388.45 g/mol, XLogP of 4.85, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-phenyl-2-pyridinyl) sulfite is sourced from PubChem (CID 58871012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).