4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide

C16H13Cl3N2O3 — CID 31956715

IUPAC4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide
SMILESCOc1cc(Cl)ccc1C(=O)NNC(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H13Cl3N2O3/c1-24-14-8-11(18)4-5-12(14)16(23)21-20-15(22)6-9-2-3-10(17)7-13(9)19/h2-5,7-8H,6H2,1H3,(H,20,22)(H,21,23)
InChIKeyHYFFDJURKQQWNN-UHFFFAOYSA-N
MW387.65 g/mol
LogP3.66
Rot. Bonds4

About 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide

4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide (PubChem CID 31956715) has the molecular formula C16H13Cl3N2O3 and a molecular weight of 387.65 g/mol. Its IUPAC name is 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide.

Molecular Properties

Compound Name4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide
PubChem CID31956715
Molecular FormulaC16H13Cl3N2O3
Molecular Weight387.65 g/mol
Exact Mass386.00
IUPAC Name4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide
SMILESCOc1cc(Cl)ccc1C(=O)NNC(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H13Cl3N2O3/c1-24-14-8-11(18)4-5-12(14)16(23)21-20-15(22)6-9-2-3-10(17)7-13(9)19/h2-5,7-8H,6H2,1H3,(H,20,22)(H,21,23)
InChIKeyHYFFDJURKQQWNN-UHFFFAOYSA-N
XLogP3.66
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.65
LogP ≤ 53.66
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-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide?
The IUPAC name of 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide (CID 31956715) is 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide.
What is the SMILES notation for 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide?
The canonical SMILES for 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide is COc1cc(Cl)ccc1C(=O)NNC(=O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide?
The InChIKey is HYFFDJURKQQWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl3N2O3/c1-24-14-8-11(18)4-5-12(14)16(23)21-20-15(22)6-9-2-3-10(17)7-13(9)19/h2-5,7-8H,6H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide?
4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide has a molecular weight of 387.65 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-[2-(2,4-dichlorophenyl)acetyl]-2-methoxybenzohydrazide is sourced from PubChem (CID 31956715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).