[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine

C16H19BrN2S — CID 105238066

IUPAC[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C(CSc2ccccc2Br)NN)c1C
InChIInChI=1S/C16H19BrN2S/c1-11-6-5-7-13(12(11)2)15(19-18)10-20-16-9-4-3-8-14(16)17/h3-9,15,19H,10,18H2,1-2H3
InChIKeyQPZZVQZVIOQMQW-UHFFFAOYSA-N
MW351.31 g/mol
LogP4.36
Rot. Bonds5

About [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine

[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine (PubChem CID 105238066) has the molecular formula C16H19BrN2S and a molecular weight of 351.31 g/mol. Its IUPAC name is [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine
PubChem CID105238066
Molecular FormulaC16H19BrN2S
Molecular Weight351.31 g/mol
Exact Mass350.05
IUPAC Name[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C(CSc2ccccc2Br)NN)c1C
InChIInChI=1S/C16H19BrN2S/c1-11-6-5-7-13(12(11)2)15(19-18)10-20-16-9-4-3-8-14(16)17/h3-9,15,19H,10,18H2,1-2H3
InChIKeyQPZZVQZVIOQMQW-UHFFFAOYSA-N
XLogP4.36
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.31
LogP ≤ 54.36
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-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethanol
CID 66144051
[2-(2-bromophenyl)sulfanyl-1-(2,3-difluoro-4-methylphenyl)ethyl]hydrazine
CID 107516429
[2-(2-bromophenyl)sulfanyl-1-(2-methoxyphenyl)ethyl]hydrazine
CID 105238032
[1-(3-bromo-2-fluorophenyl)-2-(2-fluorophenyl)sulfanylethyl]hydrazine
CID 106649115
3-[2-(2-bromophenyl)sulfanyl-1-hydrazinylethyl]pyridin-4-amine
CID 105238112
[2-(2-methylphenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105237305
[1-(2,3-dimethylphenyl)-4-methylpentyl]hydrazine
CID 105207464
[1-(3-bromo-2-methylphenyl)-2-(2-bromophenyl)ethyl]hydrazine
CID 105283961
[1-(3-bromo-2-methylphenyl)-3-methylbut-3-enyl]hydrazine
CID 105319639
[2-(2-bromophenyl)sulfanyl-1-(4-bromo-1-propan-2-ylpyrazol-5-yl)ethyl]hydrazine
CID 105238052
[1-(5-fluoro-2-methylphenyl)-2-(2-methylphenyl)sulfanylethyl]hydrazine
CID 105237339
3-(2,3-dimethylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259123

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine (CID 105238066) is [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine is Cc1cccc(C(CSc2ccccc2Br)NN)c1C.
What is the InChIKey of [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine?
The InChIKey is QPZZVQZVIOQMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2S/c1-11-6-5-7-13(12(11)2)15(19-18)10-20-16-9-4-3-8-14(16)17/h3-9,15,19H,10,18H2,1-2H3.
What are the key properties of [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine?
[2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine has a molecular weight of 351.31 g/mol, XLogP of 4.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromophenyl)sulfanyl-1-(2,3-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105238066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).