[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine

C14H15BrN2S — CID 105238272

IUPAC[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)c1ccccc1
InChIInChI=1S/C14H15BrN2S/c15-12-7-4-8-13(9-12)18-10-14(17-16)11-5-2-1-3-6-11/h1-9,14,17H,10,16H2
InChIKeyQWOHEWORCDTYLY-UHFFFAOYSA-N
MW323.26 g/mol
LogP3.75
Rot. Bonds5

About [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine

[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine (PubChem CID 105238272) has the molecular formula C14H15BrN2S and a molecular weight of 323.26 g/mol. Its IUPAC name is [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
PubChem CID105238272
Molecular FormulaC14H15BrN2S
Molecular Weight323.26 g/mol
Exact Mass322.01
IUPAC Name[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)c1ccccc1
InChIInChI=1S/C14H15BrN2S/c15-12-7-4-8-13(9-12)18-10-14(17-16)11-5-2-1-3-6-11/h1-9,14,17H,10,16H2
InChIKeyQWOHEWORCDTYLY-UHFFFAOYSA-N
XLogP3.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.26
LogP ≤ 53.75
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

2-(3-bromophenyl)sulfanyl-N-methyl-1-phenylethanamine
CID 64632010
[2-(4-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105235850
[2-(3-bromophenyl)sulfanyl-1-(furan-3-yl)ethyl]hydrazine
CID 105238462
[2-(3-bromophenyl)sulfanyl-1-(3,4-difluorophenyl)ethyl]hydrazine
CID 105238376
[2-(3-bromophenyl)sulfanyl-1-(2-chloro-5-fluorophenyl)ethyl]hydrazine
CID 105397876
[2-(3-bromophenyl)sulfanyl-1-(2-ethylpyrazol-3-yl)ethyl]hydrazine
CID 105238409
[2-(3-bromophenyl)sulfanyl-1-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105238344
[1-(4-chlorophenyl)-2-phenylsulfanylethyl]hydrazine
CID 105228100
[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
CID 105238390
1-(3-bromophenyl)sulfanylhexan-2-ylhydrazine
CID 105238265
[1-(3-bromophenyl)sulfanyl-4-ethylhexan-2-yl]hydrazine
CID 105238478
[1-(4-ethylphenyl)-2-phenylsulfanylethyl]hydrazine
CID 105228219

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine?
The IUPAC name of [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine (CID 105238272) is [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine.
What is the SMILES notation for [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine?
The canonical SMILES for [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine is NNC(CSc1cccc(Br)c1)c1ccccc1.
What is the InChIKey of [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine?
The InChIKey is QWOHEWORCDTYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2S/c15-12-7-4-8-13(9-12)18-10-14(17-16)11-5-2-1-3-6-11/h1-9,14,17H,10,16H2.
What are the key properties of [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine?
[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine has a molecular weight of 323.26 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine is sourced from PubChem (CID 105238272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).