diphenyl-di(quinolin-8-yloxy)stannane

C30H22N2O2Sn — CID 16683148

IUPACdiphenyl-di(quinolin-8-yloxy)stannane
SMILESc1ccc([Sn](Oc2cccc3cccnc23)(Oc2cccc3cccnc23)c2ccccc2)cc1
InChIInChI=1S/2C9H7NO.2C6H5.Sn/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;2*1-2-4-6-5-3-1;/h2*1-6,11H;2*1-5H;/q;;;;+2/p-2
InChIKeyAKJXSKGJAIBMJQ-UHFFFAOYSA-L
MW561.23 g/mol
LogP5.50
Rot. Bonds6

About diphenyl-di(quinolin-8-yloxy)stannane

diphenyl-di(quinolin-8-yloxy)stannane (PubChem CID 16683148) has the molecular formula C30H22N2O2Sn and a molecular weight of 561.23 g/mol. Its IUPAC name is diphenyl-di(quinolin-8-yloxy)stannane.

Molecular Properties

Compound Namediphenyl-di(quinolin-8-yloxy)stannane
PubChem CID16683148
Molecular FormulaC30H22N2O2Sn
Molecular Weight561.23 g/mol
Exact Mass562.07
IUPAC Namediphenyl-di(quinolin-8-yloxy)stannane
SMILESc1ccc([Sn](Oc2cccc3cccnc23)(Oc2cccc3cccnc23)c2ccccc2)cc1
InChIInChI=1S/2C9H7NO.2C6H5.Sn/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;2*1-2-4-6-5-3-1;/h2*1-6,11H;2*1-5H;/q;;;;+2/p-2
InChIKeyAKJXSKGJAIBMJQ-UHFFFAOYSA-L
XLogP5.50
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.23
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of diphenyl-di(quinolin-8-yloxy)stannane?
The IUPAC name of diphenyl-di(quinolin-8-yloxy)stannane (CID 16683148) is diphenyl-di(quinolin-8-yloxy)stannane.
What is the SMILES notation for diphenyl-di(quinolin-8-yloxy)stannane?
The canonical SMILES for diphenyl-di(quinolin-8-yloxy)stannane is c1ccc([Sn](Oc2cccc3cccnc23)(Oc2cccc3cccnc23)c2ccccc2)cc1.
What is the InChIKey of diphenyl-di(quinolin-8-yloxy)stannane?
The InChIKey is AKJXSKGJAIBMJQ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H7NO.2C6H5.Sn/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;2*1-2-4-6-5-3-1;/h2*1-6,11H;2*1-5H;/q;;;;+2/p-2.
What are the key properties of diphenyl-di(quinolin-8-yloxy)stannane?
diphenyl-di(quinolin-8-yloxy)stannane has a molecular weight of 561.23 g/mol, XLogP of 5.50, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-di(quinolin-8-yloxy)stannane is sourced from PubChem (CID 16683148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).