benzenesulfonylmethyl(triphenyl)stannane

C25H22O2SSn — CID 21409449

IUPACbenzenesulfonylmethyl(triphenyl)stannane
SMILESO=S(=O)(C[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C7H7O2S.3C6H5.Sn/c1-10(8,9)7-5-3-2-4-6-7;3*1-2-4-6-5-3-1;/h2-6H,1H2;3*1-5H;
InChIKeyDULPPUZDANCRBR-UHFFFAOYSA-N
MW505.23 g/mol
LogP3.17
Rot. Bonds6

About benzenesulfonylmethyl(triphenyl)stannane

benzenesulfonylmethyl(triphenyl)stannane (PubChem CID 21409449) has the molecular formula C25H22O2SSn and a molecular weight of 505.23 g/mol. Its IUPAC name is benzenesulfonylmethyl(triphenyl)stannane.

Molecular Properties

Compound Namebenzenesulfonylmethyl(triphenyl)stannane
PubChem CID21409449
Molecular FormulaC25H22O2SSn
Molecular Weight505.23 g/mol
Exact Mass506.04
IUPAC Namebenzenesulfonylmethyl(triphenyl)stannane
SMILESO=S(=O)(C[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C7H7O2S.3C6H5.Sn/c1-10(8,9)7-5-3-2-4-6-7;3*1-2-4-6-5-3-1;/h2-6H,1H2;3*1-5H;
InChIKeyDULPPUZDANCRBR-UHFFFAOYSA-N
XLogP3.17
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500505.23
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzenesulfonylmethyl(triphenyl)stannane?
The IUPAC name of benzenesulfonylmethyl(triphenyl)stannane (CID 21409449) is benzenesulfonylmethyl(triphenyl)stannane.
What is the SMILES notation for benzenesulfonylmethyl(triphenyl)stannane?
The canonical SMILES for benzenesulfonylmethyl(triphenyl)stannane is O=S(=O)(C[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of benzenesulfonylmethyl(triphenyl)stannane?
The InChIKey is DULPPUZDANCRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O2S.3C6H5.Sn/c1-10(8,9)7-5-3-2-4-6-7;3*1-2-4-6-5-3-1;/h2-6H,1H2;3*1-5H;.
What are the key properties of benzenesulfonylmethyl(triphenyl)stannane?
benzenesulfonylmethyl(triphenyl)stannane has a molecular weight of 505.23 g/mol, XLogP of 3.17, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzenesulfonylmethyl(triphenyl)stannane is sourced from PubChem (CID 21409449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).