[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine

C13H10BrCl3N2 — CID 107996585

IUPAC[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H10BrCl3N2/c14-10-6-8(15)2-3-9(10)13(19-18)7-1-4-11(16)12(17)5-7/h1-6,13,19H,18H2
InChIKeyVSHVRXKIQKHMTD-UHFFFAOYSA-N
MW380.50 g/mol
LogP4.96
Rot. Bonds3

About [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine

[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine (PubChem CID 107996585) has the molecular formula C13H10BrCl3N2 and a molecular weight of 380.50 g/mol. Its IUPAC name is [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
PubChem CID107996585
Molecular FormulaC13H10BrCl3N2
Molecular Weight380.50 g/mol
Exact Mass377.91
IUPAC Name[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H10BrCl3N2/c14-10-6-8(15)2-3-9(10)13(19-18)7-1-4-11(16)12(17)5-7/h1-6,13,19H,18H2
InChIKeyVSHVRXKIQKHMTD-UHFFFAOYSA-N
XLogP4.96
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.50
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine (CID 107996585) is [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine is NNC(c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1Br.
What is the InChIKey of [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine?
The InChIKey is VSHVRXKIQKHMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrCl3N2/c14-10-6-8(15)2-3-9(10)13(19-18)7-1-4-11(16)12(17)5-7/h1-6,13,19H,18H2.
What are the key properties of [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine?
[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine has a molecular weight of 380.50 g/mol, XLogP of 4.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine is sourced from PubChem (CID 107996585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).