4-bromo-3,5-dichlorobenzohydrazide

C7H5BrCl2N2O — CID 169499880

IUPAC4-bromo-3,5-dichlorobenzohydrazide
SMILESNNC(=O)c1cc(Cl)c(Br)c(Cl)c1
InChIInChI=1S/C7H5BrCl2N2O/c8-6-4(9)1-3(2-5(6)10)7(13)12-11/h1-2H,11H2,(H,12,13)
InChIKeyRPSYCXFJYMQXSX-UHFFFAOYSA-N
MW283.94 g/mol
LogP2.36
Rot. Bonds1

About 4-bromo-3,5-dichlorobenzohydrazide

4-bromo-3,5-dichlorobenzohydrazide (PubChem CID 169499880) has the molecular formula C7H5BrCl2N2O and a molecular weight of 283.94 g/mol. Its IUPAC name is 4-bromo-3,5-dichlorobenzohydrazide.

Molecular Properties

Compound Name4-bromo-3,5-dichlorobenzohydrazide
PubChem CID169499880
Molecular FormulaC7H5BrCl2N2O
Molecular Weight283.94 g/mol
Exact Mass281.90
IUPAC Name4-bromo-3,5-dichlorobenzohydrazide
SMILESNNC(=O)c1cc(Cl)c(Br)c(Cl)c1
InChIInChI=1S/C7H5BrCl2N2O/c8-6-4(9)1-3(2-5(6)10)7(13)12-11/h1-2H,11H2,(H,12,13)
InChIKeyRPSYCXFJYMQXSX-UHFFFAOYSA-N
XLogP2.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.94
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,5-dichlorobenzohydrazide
CID 2735966
1-(4-bromo-3,5-dichlorophenyl)-2-chloroethanone
CID 171004358
3-chloro-4-hydroxybenzohydrazide
CID 10954268
3-chloro-4-hydroxy-5-methoxybenzohydrazide
CID 67488577
5-chloro-6-oxo-1H-pyridine-3-carbohydrazide
CID 130843008
5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbohydrazide
CID 43236687
2,5-dichlorobenzene-1,4-dicarbohydrazide
CID 124926031
3-bromo-5-iodobenzohydrazide
CID 130139017
3-bromo-5-chloro-4-[(2-chlorophenyl)methoxy]benzohydrazide
CID 91685973
2-(4-bromo-3,5-dichlorophenyl)acetamide
CID 174389089
methyl 2-chloro-4-(hydrazinecarbonyl)benzoate
CID 67050317
2-bromo-6-methylpyridine-4-carbohydrazide
CID 45117000

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3,5-dichlorobenzohydrazide?
The IUPAC name of 4-bromo-3,5-dichlorobenzohydrazide (CID 169499880) is 4-bromo-3,5-dichlorobenzohydrazide.
What is the SMILES notation for 4-bromo-3,5-dichlorobenzohydrazide?
The canonical SMILES for 4-bromo-3,5-dichlorobenzohydrazide is NNC(=O)c1cc(Cl)c(Br)c(Cl)c1.
What is the InChIKey of 4-bromo-3,5-dichlorobenzohydrazide?
The InChIKey is RPSYCXFJYMQXSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrCl2N2O/c8-6-4(9)1-3(2-5(6)10)7(13)12-11/h1-2H,11H2,(H,12,13).
What are the key properties of 4-bromo-3,5-dichlorobenzohydrazide?
4-bromo-3,5-dichlorobenzohydrazide has a molecular weight of 283.94 g/mol, XLogP of 2.36, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3,5-dichlorobenzohydrazide is sourced from PubChem (CID 169499880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).