[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine

C14H15ClN2S — CID 105228100

IUPAC[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine
SMILESNNC(CSc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2S/c15-12-8-6-11(7-9-12)14(17-16)10-18-13-4-2-1-3-5-13/h1-9,14,17H,10,16H2
InChIKeyPMGWRMRYKNAAOA-UHFFFAOYSA-N
MW278.81 g/mol
LogP3.64
Rot. Bonds5

About [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine

[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine (PubChem CID 105228100) has the molecular formula C14H15ClN2S and a molecular weight of 278.81 g/mol. Its IUPAC name is [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine
PubChem CID105228100
Molecular FormulaC14H15ClN2S
Molecular Weight278.81 g/mol
Exact Mass278.06
IUPAC Name[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine
SMILESNNC(CSc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2S/c15-12-8-6-11(7-9-12)14(17-16)10-18-13-4-2-1-3-5-13/h1-9,14,17H,10,16H2
InChIKeyPMGWRMRYKNAAOA-UHFFFAOYSA-N
XLogP3.64
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.81
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-ethylphenyl)-2-phenylsulfanylethyl]hydrazine
CID 105228219
[2-(4-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105235850
[2-(3-chlorophenyl)sulfanyl-1-(4-fluorophenyl)ethyl]hydrazine
CID 105237907
[1-(5-chloro-1-benzofuran-2-yl)-2-phenylsulfanylethyl]hydrazine
CID 105228018
[1-(4-chlorophenyl)-2-ethylsulfanylethyl]hydrazine
CID 105225335
[1-(4-chlorophenyl)-3-phenylpropyl]hydrazine
CID 105193229
[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105238272
N-[(1R)-2-(4-chlorophenyl)sulfanyl-1-phenylethyl]formamide
CID 124926697
(1-naphthalen-1-yl-2-phenylsulfanylethyl)hydrazine
CID 105228218
[1-(5-methylthiophen-3-yl)-2-phenylsulfanylethyl]hydrazine
CID 105228237
[2-(3-fluorophenyl)sulfanyl-1-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105236551
[1-(3,4-difluorophenyl)-2-(4-fluorophenyl)sulfanylethyl]hydrazine
CID 105236679

Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine?
The IUPAC name of [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine (CID 105228100) is [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine is NNC(CSc1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine?
The InChIKey is PMGWRMRYKNAAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2S/c15-12-8-6-11(7-9-12)14(17-16)10-18-13-4-2-1-3-5-13/h1-9,14,17H,10,16H2.
What are the key properties of [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine?
[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine has a molecular weight of 278.81 g/mol, XLogP of 3.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine is sourced from PubChem (CID 105228100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).