N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide

C20H18N2S — CID 134928433

IUPACN-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide
SMILESC/C(N=S(c1ccccc1)c1ccccc1)=N\c1ccccc1
InChIInChI=1S/C20H18N2S/c1-17(21-18-11-5-2-6-12-18)22-23(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3/b21-17+
InChIKeyIILYDVQFOGASOK-HEHNFIMWSA-N
MW318.44 g/mol
LogP5.66
Rot. Bonds3

About N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide

N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide (PubChem CID 134928433) has the molecular formula C20H18N2S and a molecular weight of 318.44 g/mol. Its IUPAC name is N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide.

Molecular Properties

Compound NameN-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide
PubChem CID134928433
Molecular FormulaC20H18N2S
Molecular Weight318.44 g/mol
Exact Mass318.12
IUPAC NameN-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide
SMILESC/C(N=S(c1ccccc1)c1ccccc1)=N\c1ccccc1
InChIInChI=1S/C20H18N2S/c1-17(21-18-11-5-2-6-12-18)22-23(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3/b21-17+
InChIKeyIILYDVQFOGASOK-HEHNFIMWSA-N
XLogP5.66
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.44
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N,3-N-diphenylbutane-2,3-diimine;dihydrochloride
CID 172723144
dibromoiron;2-N,3-N-diphenylbutane-2,3-diimine
CID 164938268
bis(2-phenylguanidine);dihydrochloride
CID 160984545
3-phenyliminobutan-2-one
CID 12823040
deuteriomethane;ethane;2-phenylguanidine
CID 91130505
ethanol;2-phenylguanidine
CID 172840613
2,4-dimethyl-N-phenylpentan-3-imine
CID 14316363
N-(diphenyl-λ4-sulfanylidene)-N'-(2-methylphenyl)-2-phenylethanimidamide
CID 134928838
ethane;methyl-methylidene-phenyl-λ4-sulfane
CID 91087934
diphenyl(propan-2-ylidene)-λ4-sulfane
CID 11138905
(Z)-5-methyl-4-phenyliminohex-2-en-2-amine
CID 177051041
N-(diphenyl-λ4-sulfanylidene)-2,2,2-trifluoroacetamide
CID 11254966

Frequently Asked Questions

What is the IUPAC name of N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide?
The IUPAC name of N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide (CID 134928433) is N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide.
What is the SMILES notation for N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide?
The canonical SMILES for N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide is C/C(N=S(c1ccccc1)c1ccccc1)=N\c1ccccc1.
What is the InChIKey of N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide?
The InChIKey is IILYDVQFOGASOK-HEHNFIMWSA-N. The full InChI is InChI=1S/C20H18N2S/c1-17(21-18-11-5-2-6-12-18)22-23(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3/b21-17+.
What are the key properties of N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide?
N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide has a molecular weight of 318.44 g/mol, XLogP of 5.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diphenyl-λ4-sulfanylidene)-N'-phenylethanimidamide is sourced from PubChem (CID 134928433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).