[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine

C11H9Br2FN2S — CID 105322671

IUPAC[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(F)c1)c1cscc1Br
InChIInChI=1S/C11H9Br2FN2S/c12-8-2-1-6(3-10(8)14)11(16-15)7-4-17-5-9(7)13/h1-5,11,16H,15H2
InChIKeyVZCREJSDTCKFOM-UHFFFAOYSA-N
MW380.08 g/mol
LogP3.96
Rot. Bonds3

About [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine

[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine (PubChem CID 105322671) has the molecular formula C11H9Br2FN2S and a molecular weight of 380.08 g/mol. Its IUPAC name is [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine
PubChem CID105322671
Molecular FormulaC11H9Br2FN2S
Molecular Weight380.08 g/mol
Exact Mass377.88
IUPAC Name[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(F)c1)c1cscc1Br
InChIInChI=1S/C11H9Br2FN2S/c12-8-2-1-6(3-10(8)14)11(16-15)7-4-17-5-9(7)13/h1-5,11,16H,15H2
InChIKeyVZCREJSDTCKFOM-UHFFFAOYSA-N
XLogP3.96
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.08
LogP ≤ 53.96
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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Frequently Asked Questions

What is the IUPAC name of [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine?
The IUPAC name of [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine (CID 105322671) is [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine is NNC(c1ccc(Br)c(F)c1)c1cscc1Br.
What is the InChIKey of [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine?
The InChIKey is VZCREJSDTCKFOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Br2FN2S/c12-8-2-1-6(3-10(8)14)11(16-15)7-4-17-5-9(7)13/h1-5,11,16H,15H2.
What are the key properties of [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine?
[(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine has a molecular weight of 380.08 g/mol, XLogP of 3.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-3-fluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 105322671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).