2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide

C15H9Cl2F3N2O3 — CID 2744744

IUPAC2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
SMILESO=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C15H9Cl2F3N2O3/c16-9-3-6-11(12(17)7-9)14(24)22-21-13(23)8-1-4-10(5-2-8)25-15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyYJLGJENRFAVPQF-UHFFFAOYSA-N
MW393.15 g/mol
LogP3.97
Rot. Bonds3

About 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide

2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide (PubChem CID 2744744) has the molecular formula C15H9Cl2F3N2O3 and a molecular weight of 393.15 g/mol. Its IUPAC name is 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide.

Molecular Properties

Compound Name2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
PubChem CID2744744
Molecular FormulaC15H9Cl2F3N2O3
Molecular Weight393.15 g/mol
Exact Mass391.99
IUPAC Name2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
SMILESO=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C15H9Cl2F3N2O3/c16-9-3-6-11(12(17)7-9)14(24)22-21-13(23)8-1-4-10(5-2-8)25-15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyYJLGJENRFAVPQF-UHFFFAOYSA-N
XLogP3.97
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.15
LogP ≤ 53.97
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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Related Compounds

2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide
CID 4952081
4-chloro-N'-[3-[4-(trifluoromethoxy)phenyl]prop-2-enoyl]benzohydrazide
CID 2741847
2,4-dichloro-N'-(4-nitrobenzoyl)benzohydrazide
CID 3591876
N-(5-chloro-2-methylphenyl)-4-(trifluoromethoxy)benzamide
CID 2107466
N'-tert-butyl-2,4-dichloro-N-methyl-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
CID 19752817
4-chloro-N'-(4-chlorobenzoyl)-2-fluorobenzohydrazide
CID 9075928
(4-chlorophenyl)-[4-(trifluoromethoxy)phenyl]methanone
CID 3021169
2,4-dichloro-N'-[5-nitro-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzohydrazide
CID 22536432
2-chloro-4-fluoro-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 26643241
methyl 4-[[(2,4-dichlorobenzoyl)amino]carbamothioylcarbamoyl]benzoate
CID 17178688
N-(3,4-dichlorophenyl)-4-(trifluoromethoxy)benzamide
CID 18267923
(4-amino-2-chlorophenyl)-[4-(trifluoromethoxy)phenyl]methanone
CID 116629442

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide?
The IUPAC name of 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide (CID 2744744) is 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide.
What is the SMILES notation for 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide?
The canonical SMILES for 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide is O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide?
The InChIKey is YJLGJENRFAVPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F3N2O3/c16-9-3-6-11(12(17)7-9)14(24)22-21-13(23)8-1-4-10(5-2-8)25-15(18,19)20/h1-7H,(H,21,23)(H,22,24).
What are the key properties of 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide?
2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide has a molecular weight of 393.15 g/mol, XLogP of 3.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide is sourced from PubChem (CID 2744744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).