methylimino(diphenyl)-λ4-sulfane

C13H13NS — CID 24972412

IUPACmethylimino(diphenyl)-λ4-sulfane
SMILESCN=S(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NS/c1-14-15(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyMFWFVZPDJVKOQI-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.54
Rot. Bonds2

About methylimino(diphenyl)-λ4-sulfane

methylimino(diphenyl)-λ4-sulfane (PubChem CID 24972412) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is methylimino(diphenyl)-λ4-sulfane.

Molecular Properties

Compound Namemethylimino(diphenyl)-λ4-sulfane
PubChem CID24972412
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Namemethylimino(diphenyl)-λ4-sulfane
SMILESCN=S(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NS/c1-14-15(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyMFWFVZPDJVKOQI-UHFFFAOYSA-N
XLogP3.54
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methylimino(diphenyl)-λ4-sulfane?
The IUPAC name of methylimino(diphenyl)-λ4-sulfane (CID 24972412) is methylimino(diphenyl)-λ4-sulfane.
What is the SMILES notation for methylimino(diphenyl)-λ4-sulfane?
The canonical SMILES for methylimino(diphenyl)-λ4-sulfane is CN=S(c1ccccc1)c1ccccc1.
What is the InChIKey of methylimino(diphenyl)-λ4-sulfane?
The InChIKey is MFWFVZPDJVKOQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NS/c1-14-15(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3.
What are the key properties of methylimino(diphenyl)-λ4-sulfane?
methylimino(diphenyl)-λ4-sulfane has a molecular weight of 215.32 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methylimino(diphenyl)-λ4-sulfane is sourced from PubChem (CID 24972412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).