tetraphenyl-λ4-sulfane

C24H20S — CID 21274877

IUPACtetraphenyl-λ4-sulfane
SMILESc1ccc(S(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20S/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyVMZBNIRXGJODON-UHFFFAOYSA-N
MW340.49 g/mol
LogP7.03
Rot. Bonds4

About tetraphenyl-λ4-sulfane

tetraphenyl-λ4-sulfane (PubChem CID 21274877) has the molecular formula C24H20S and a molecular weight of 340.49 g/mol. Its IUPAC name is tetraphenyl-λ4-sulfane.

Molecular Properties

Compound Nametetraphenyl-λ4-sulfane
PubChem CID21274877
Molecular FormulaC24H20S
Molecular Weight340.49 g/mol
Exact Mass340.13
IUPAC Nametetraphenyl-λ4-sulfane
SMILESc1ccc(S(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20S/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyVMZBNIRXGJODON-UHFFFAOYSA-N
XLogP7.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.49
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tetraphenyl-λ4-sulfane?
The IUPAC name of tetraphenyl-λ4-sulfane (CID 21274877) is tetraphenyl-λ4-sulfane.
What is the SMILES notation for tetraphenyl-λ4-sulfane?
The canonical SMILES for tetraphenyl-λ4-sulfane is c1ccc(S(c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of tetraphenyl-λ4-sulfane?
The InChIKey is VMZBNIRXGJODON-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20S/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H.
What are the key properties of tetraphenyl-λ4-sulfane?
tetraphenyl-λ4-sulfane has a molecular weight of 340.49 g/mol, XLogP of 7.03, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetraphenyl-λ4-sulfane is sourced from PubChem (CID 21274877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).