2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide

C21H16Cl2N2O3 — CID 24637056

IUPAC2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1ccc(COc2ccc(Cl)cc2)cc1
InChIInChI=1S/C21H16Cl2N2O3/c22-16-9-11-17(12-10-16)28-13-14-5-7-15(8-6-14)20(26)24-25-21(27)18-3-1-2-4-19(18)23/h1-12H,13H2,(H,24,26)(H,25,27)
InChIKeyBNDFOYIUOCYEMO-UHFFFAOYSA-N
MW415.28 g/mol
LogP4.65
Rot. Bonds5

About 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide

2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide (PubChem CID 24637056) has the molecular formula C21H16Cl2N2O3 and a molecular weight of 415.28 g/mol. Its IUPAC name is 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide.

Molecular Properties

Compound Name2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide
PubChem CID24637056
Molecular FormulaC21H16Cl2N2O3
Molecular Weight415.28 g/mol
Exact Mass414.05
IUPAC Name2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1ccc(COc2ccc(Cl)cc2)cc1
InChIInChI=1S/C21H16Cl2N2O3/c22-16-9-11-17(12-10-16)28-13-14-5-7-15(8-6-14)20(26)24-25-21(27)18-3-1-2-4-19(18)23/h1-12H,13H2,(H,24,26)(H,25,27)
InChIKeyBNDFOYIUOCYEMO-UHFFFAOYSA-N
XLogP4.65
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.28
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide with MolForge

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

Launch Full Analysis

Related Compounds

N'-benzoyl-4-[(4-chlorophenoxy)methyl]benzohydrazide
CID 4880251
2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
CID 17353590
N'-(2-chlorobenzoyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzohydrazide
CID 35929028
2-chloro-N'-[4-(2-phenylethoxy)benzoyl]benzohydrazide
CID 4956612
2-fluoro-N'-[4-(phenoxymethyl)benzoyl]benzohydrazide
CID 4875820
2-chloro-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4930070
N'-[4-[(4-chloro-3-methylphenoxy)methyl]benzoyl]-2-fluorobenzohydrazide
CID 18289024
N'-butanoyl-4-[(4-chlorophenoxy)methyl]benzohydrazide
CID 24536714
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
N-[2-[2-[4-[(4-chlorophenoxy)methyl]benzoyl]hydrazinyl]-2-oxoethyl]-2-phenoxyacetamide
CID 22108267
2-chloro-N'-[4-(3-methylbutoxy)benzoyl]benzohydrazide
CID 4927887
4-[(4-chlorophenoxy)methyl]-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 27259570

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide?
The IUPAC name of 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide (CID 24637056) is 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide.
What is the SMILES notation for 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide?
The canonical SMILES for 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide is O=C(NNC(=O)c1ccccc1Cl)c1ccc(COc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide?
The InChIKey is BNDFOYIUOCYEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16Cl2N2O3/c22-16-9-11-17(12-10-16)28-13-14-5-7-15(8-6-14)20(26)24-25-21(27)18-3-1-2-4-19(18)23/h1-12H,13H2,(H,24,26)(H,25,27).
What are the key properties of 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide?
2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide has a molecular weight of 415.28 g/mol, XLogP of 4.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide is sourced from PubChem (CID 24637056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).