4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide

C12H10Br2N2O2S — CID 118706945

IUPAC4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1ccc(Br)cc1)c1ccc(Br)cc1
InChIInChI=1S/C12H10Br2N2O2S/c13-9-1-5-11(6-2-9)15-16-19(17,18)12-7-3-10(14)4-8-12/h1-8,15-16H
InChIKeyWWYQFUUHPILXKG-UHFFFAOYSA-N
MW406.10 g/mol
LogP3.52
Rot. Bonds4

About 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide

4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide (PubChem CID 118706945) has the molecular formula C12H10Br2N2O2S and a molecular weight of 406.10 g/mol. Its IUPAC name is 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide.

Molecular Properties

Compound Name4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide
PubChem CID118706945
Molecular FormulaC12H10Br2N2O2S
Molecular Weight406.10 g/mol
Exact Mass403.88
IUPAC Name4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1ccc(Br)cc1)c1ccc(Br)cc1
InChIInChI=1S/C12H10Br2N2O2S/c13-9-1-5-11(6-2-9)15-16-19(17,18)12-7-3-10(14)4-8-12/h1-8,15-16H
InChIKeyWWYQFUUHPILXKG-UHFFFAOYSA-N
XLogP3.52
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.10
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide?
The IUPAC name of 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide (CID 118706945) is 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide.
What is the SMILES notation for 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide?
The canonical SMILES for 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide is O=S(=O)(NNc1ccc(Br)cc1)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide?
The InChIKey is WWYQFUUHPILXKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N2O2S/c13-9-1-5-11(6-2-9)15-16-19(17,18)12-7-3-10(14)4-8-12/h1-8,15-16H.
What are the key properties of 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide?
4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide has a molecular weight of 406.10 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N'-(4-bromophenyl)benzenesulfonohydrazide is sourced from PubChem (CID 118706945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).