azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane

C24H19NS — CID 102435167

IUPACazanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane
SMILESN#S(c1ccccc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H19NS/c25-26(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-18-16-21(17-19-24)20-10-4-1-5-11-20/h1-19H
InChIKeyDGBQVSWEMHHRTR-UHFFFAOYSA-N
MW353.49 g/mol
LogP7.11
Rot. Bonds1

About azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane

azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane (PubChem CID 102435167) has the molecular formula C24H19NS and a molecular weight of 353.49 g/mol. Its IUPAC name is azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane.

Molecular Properties

Compound Nameazanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane
PubChem CID102435167
Molecular FormulaC24H19NS
Molecular Weight353.49 g/mol
Exact Mass353.12
IUPAC Nameazanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane
SMILESN#S(c1ccccc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H19NS/c25-26(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-18-16-21(17-19-24)20-10-4-1-5-11-20/h1-19H
InChIKeyDGBQVSWEMHHRTR-UHFFFAOYSA-N
XLogP7.11
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.49
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane?
The IUPAC name of azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane (CID 102435167) is azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane.
What is the SMILES notation for azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane?
The canonical SMILES for azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane is N#S(c1ccccc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane?
The InChIKey is DGBQVSWEMHHRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NS/c25-26(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-18-16-21(17-19-24)20-10-4-1-5-11-20/h1-19H.
What are the key properties of azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane?
azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane has a molecular weight of 353.49 g/mol, XLogP of 7.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azanylidyne-diphenyl-(4-phenylphenyl)-λ6-sulfane is sourced from PubChem (CID 102435167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).