[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine

C15H11BrClFN2O — CID 105261142

IUPAC[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)c(Br)c1)c1cc2cc(F)ccc2o1
InChIInChI=1S/C15H11BrClFN2O/c16-11-6-8(1-3-12(11)17)15(20-19)14-7-9-5-10(18)2-4-13(9)21-14/h1-7,15,20H,19H2
InChIKeyXLDOZTWONFIZDX-UHFFFAOYSA-N
MW369.62 g/mol
LogP4.54
Rot. Bonds3

About [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine

[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine (PubChem CID 105261142) has the molecular formula C15H11BrClFN2O and a molecular weight of 369.62 g/mol. Its IUPAC name is [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
PubChem CID105261142
Molecular FormulaC15H11BrClFN2O
Molecular Weight369.62 g/mol
Exact Mass367.97
IUPAC Name[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)c(Br)c1)c1cc2cc(F)ccc2o1
InChIInChI=1S/C15H11BrClFN2O/c16-11-6-8(1-3-12(11)17)15(20-19)14-7-9-5-10(18)2-4-13(9)21-14/h1-7,15,20H,19H2
InChIKeyXLDOZTWONFIZDX-UHFFFAOYSA-N
XLogP4.54
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.62
LogP ≤ 54.54
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

[(4-chloro-3-fluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 107997332
[(5-fluoro-1-benzofuran-2-yl)-(3-fluorophenyl)methyl]hydrazine
CID 105193194
[(2-bromo-5-fluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105338716
[(3-bromo-4-chlorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105261000
[(2-bromophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105208817
[(3-bromo-4-chlorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105260967
[(3,5-dimethylphenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105338687
[(2,5-dibromophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105338683
[(4-bromo-3-chlorophenyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338291
[(5-chloro-1-benzofuran-2-yl)-(3,5-difluorophenyl)methyl]hydrazine
CID 105207773
[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine
CID 105337790
[(4-bromothiophen-2-yl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105222678

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The IUPAC name of [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine (CID 105261142) is [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine is NNC(c1ccc(Cl)c(Br)c1)c1cc2cc(F)ccc2o1.
What is the InChIKey of [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The InChIKey is XLDOZTWONFIZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrClFN2O/c16-11-6-8(1-3-12(11)17)15(20-19)14-7-9-5-10(18)2-4-13(9)21-14/h1-7,15,20H,19H2.
What are the key properties of [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine has a molecular weight of 369.62 g/mol, XLogP of 4.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105261142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).