imino(diphenyl)-lambda4-sulfane

C12H11NS — CID 608422

IUPACimino(diphenyl)-lambda4-sulfane
SMILES[H]N=S(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H11NS/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChIKeyLEXXWUCMDYEREL-UHFFFAOYSA-N
MW201.29 g/mol
LogP3.49
Rot. Bonds2

About imino(diphenyl)-lambda4-sulfane

imino(diphenyl)-lambda4-sulfane (PubChem CID 608422) has the molecular formula C12H11NS and a molecular weight of 201.29 g/mol. Its IUPAC name is imino(diphenyl)-lambda4-sulfane.

Molecular Properties

Compound Nameimino(diphenyl)-lambda4-sulfane
PubChem CID608422
Molecular FormulaC12H11NS
Molecular Weight201.29 g/mol
Exact Mass201.06
IUPAC Nameimino(diphenyl)-lambda4-sulfane
SMILES[H]N=S(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H11NS/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChIKeyLEXXWUCMDYEREL-UHFFFAOYSA-N
XLogP3.49
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of imino(diphenyl)-lambda4-sulfane?
The IUPAC name of imino(diphenyl)-lambda4-sulfane (CID 608422) is imino(diphenyl)-lambda4-sulfane.
What is the SMILES notation for imino(diphenyl)-lambda4-sulfane?
The canonical SMILES for imino(diphenyl)-lambda4-sulfane is [H]N=S(c1ccccc1)c1ccccc1.
What is the InChIKey of imino(diphenyl)-lambda4-sulfane?
The InChIKey is LEXXWUCMDYEREL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NS/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H.
What are the key properties of imino(diphenyl)-lambda4-sulfane?
imino(diphenyl)-lambda4-sulfane has a molecular weight of 201.29 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for imino(diphenyl)-lambda4-sulfane is sourced from PubChem (CID 608422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).