N-(triphenyl-λ4-sulfanyl)aniline

C24H21NS — CID 175159500

IUPACN-(triphenyl-λ4-sulfanyl)aniline
SMILESc1ccc(NS(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NS/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H
InChIKeyFZUIVWPKOLFBSF-UHFFFAOYSA-N
MW355.51 g/mol
LogP7.00
Rot. Bonds5

About N-(triphenyl-λ4-sulfanyl)aniline

N-(triphenyl-λ4-sulfanyl)aniline (PubChem CID 175159500) has the molecular formula C24H21NS and a molecular weight of 355.51 g/mol. Its IUPAC name is N-(triphenyl-λ4-sulfanyl)aniline.

Molecular Properties

Compound NameN-(triphenyl-λ4-sulfanyl)aniline
PubChem CID175159500
Molecular FormulaC24H21NS
Molecular Weight355.51 g/mol
Exact Mass355.14
IUPAC NameN-(triphenyl-λ4-sulfanyl)aniline
SMILESc1ccc(NS(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NS/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H
InChIKeyFZUIVWPKOLFBSF-UHFFFAOYSA-N
XLogP7.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.51
LogP ≤ 57.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4'-Thiodianiline
CID 8765
2-(Phenylthio)aniline
CID 365393
4-(Phenylthio)aniline
CID 96081
2,2'-Diaminodiphenylsulfide
CID 612177
3-(4-Aminophenylthio)-1-{[3-(4-aminophenylthio)phenyl]sulfonyl}benzene
CID 2244746
Benzenesulfenamide, N-phenyl-
CID 315504
3-(Phenylsulfanyl)aniline
CID 23423642
2-Triphenylstannylsulfanylaniline
CID 375212
2-(Phenylthio)aniline hydrochloride
CID 365392
3-(Phenylsulfanyl)aniline hydrochloride
CID 122164312
4-phenylsulfanyl-N-(4-phenylsulfanylphenyl)aniline
CID 3723956
Benzenamine, 4,4'-[1,4-phenylenebis(thio)]bis-
CID 12311562

Frequently Asked Questions

What is the IUPAC name of N-(triphenyl-λ4-sulfanyl)aniline?
The IUPAC name of N-(triphenyl-λ4-sulfanyl)aniline (CID 175159500) is N-(triphenyl-λ4-sulfanyl)aniline.
What is the SMILES notation for N-(triphenyl-λ4-sulfanyl)aniline?
The canonical SMILES for N-(triphenyl-λ4-sulfanyl)aniline is c1ccc(NS(c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(triphenyl-λ4-sulfanyl)aniline?
The InChIKey is FZUIVWPKOLFBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NS/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H.
What are the key properties of N-(triphenyl-λ4-sulfanyl)aniline?
N-(triphenyl-λ4-sulfanyl)aniline has a molecular weight of 355.51 g/mol, XLogP of 7.00, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(triphenyl-λ4-sulfanyl)aniline is sourced from PubChem (CID 175159500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).