5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide

C15H11Cl2IN2O3 — CID 39708070

IUPAC5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(Cl)ccc1I
InChIInChI=1S/C15H11Cl2IN2O3/c1-23-13-5-3-9(17)7-11(13)15(22)20-19-14(21)10-6-8(16)2-4-12(10)18/h2-7H,1H3,(H,19,21)(H,20,22)
InChIKeyILEZJFDKRPOPFA-UHFFFAOYSA-N
MW465.07 g/mol
LogP3.68
Rot. Bonds3

About 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide

5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide (PubChem CID 39708070) has the molecular formula C15H11Cl2IN2O3 and a molecular weight of 465.07 g/mol. Its IUPAC name is 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide.

Molecular Properties

Compound Name5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide
PubChem CID39708070
Molecular FormulaC15H11Cl2IN2O3
Molecular Weight465.07 g/mol
Exact Mass463.92
IUPAC Name5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(Cl)ccc1I
InChIInChI=1S/C15H11Cl2IN2O3/c1-23-13-5-3-9(17)7-11(13)15(22)20-19-14(21)10-6-8(16)2-4-12(10)18/h2-7H,1H3,(H,19,21)(H,20,22)
InChIKeyILEZJFDKRPOPFA-UHFFFAOYSA-N
XLogP3.68
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.07
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
4-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 29278893
5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide
CID 2469214
5-chloro-N'-(3,5-dimethoxybenzoyl)-2-methoxybenzohydrazide
CID 2091608
2,6-dichloro-N'-(5-chloro-2-methoxybenzoyl)benzohydrazide
CID 78775260
N'-(5-chloro-2-methoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
CID 4805458
N'-(4-bromo-2-fluorobenzoyl)-5-chloro-2-methoxybenzohydrazide
CID 9085244
5-chloro-2-methoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 2634898
N'-(4-chloro-2-iodobenzoyl)-3,4-dimethoxybenzohydrazide
CID 39714334
5-chloro-2-iodo-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 78873426
5-chloro-N-(2-chloro-4-hydroxyphenyl)-2-methoxybenzamide
CID 64787348
N-(4-chloro-2-iodophenyl)-2,5-dimethoxybenzamide
CID 103766869

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide?
The IUPAC name of 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide (CID 39708070) is 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide.
What is the SMILES notation for 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide?
The canonical SMILES for 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide is COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(Cl)ccc1I.
What is the InChIKey of 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide?
The InChIKey is ILEZJFDKRPOPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2IN2O3/c1-23-13-5-3-9(17)7-11(13)15(22)20-19-14(21)10-6-8(16)2-4-12(10)18/h2-7H,1H3,(H,19,21)(H,20,22).
What are the key properties of 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide?
5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide has a molecular weight of 465.07 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide is sourced from PubChem (CID 39708070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).