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

C15H12BrClN2O — CID 105337790

IUPAC[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(Cl)c1)c1cc2ccccc2o1
InChIInChI=1S/C15H12BrClN2O/c16-11-6-5-10(7-12(11)17)15(19-18)14-8-9-3-1-2-4-13(9)20-14/h1-8,15,19H,18H2
InChIKeyRGDQMWMQFDAGOK-UHFFFAOYSA-N
MW351.63 g/mol
LogP4.40
Rot. Bonds3

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

[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine (PubChem CID 105337790) has the molecular formula C15H12BrClN2O and a molecular weight of 351.63 g/mol. Its IUPAC name is [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine
PubChem CID105337790
Molecular FormulaC15H12BrClN2O
Molecular Weight351.63 g/mol
Exact Mass349.98
IUPAC Name[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(Cl)c1)c1cc2ccccc2o1
InChIInChI=1S/C15H12BrClN2O/c16-11-6-5-10(7-12(11)17)15(19-18)14-8-9-3-1-2-4-13(9)20-14/h1-8,15,19H,18H2
InChIKeyRGDQMWMQFDAGOK-UHFFFAOYSA-N
XLogP4.40
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.63
LogP ≤ 54.40
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-bromo-3-chlorophenyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338291
[1-benzofuran-2-yl-(3-bromo-4-methylphenyl)methyl]hydrazine
CID 105337744
[(3-bromo-4-chlorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105261142
[(5-chloro-1-benzofuran-2-yl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 105338541
[(4-bromo-3-chlorophenyl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 105301694
[(4-chloro-3-fluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 107997332
[1-benzofuran-2-yl-(3-ethoxyphenyl)methyl]hydrazine
CID 105192094
[1-benzothiophen-7-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine
CID 105327711
[(3,4-dichlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105257216
[(4-bromo-3-methylphenyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338351
[(5-fluoro-1-benzofuran-2-yl)-(3-fluorophenyl)methyl]hydrazine
CID 105193194
[(4-bromo-3-chlorophenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
CID 105341008

Frequently Asked Questions

What is the IUPAC name of [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine?
The IUPAC name of [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine (CID 105337790) is [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine.
What is the SMILES notation for [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine?
The canonical SMILES for [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine is NNC(c1ccc(Br)c(Cl)c1)c1cc2ccccc2o1.
What is the InChIKey of [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine?
The InChIKey is RGDQMWMQFDAGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClN2O/c16-11-6-5-10(7-12(11)17)15(19-18)14-8-9-3-1-2-4-13(9)20-14/h1-8,15,19H,18H2.
What are the key properties of [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine?
[1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine has a molecular weight of 351.63 g/mol, XLogP of 4.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzofuran-2-yl-(4-bromo-3-chlorophenyl)methyl]hydrazine is sourced from PubChem (CID 105337790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).