4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide

C24H24N2O3 — CID 7980024

IUPAC4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide
SMILESCC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-24(2,3)19-13-9-17(10-14-19)22(27)25-26-23(28)18-11-15-21(16-12-18)29-20-7-5-4-6-8-20/h4-16H,1-3H3,(H,25,27)(H,26,28)
InChIKeyYYYNNYAENMVURU-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.85
Rot. Bonds4

About 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide

4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide (PubChem CID 7980024) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide
PubChem CID7980024
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide
SMILESCC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-24(2,3)19-13-9-17(10-14-19)22(27)25-26-23(28)18-11-15-21(16-12-18)29-20-7-5-4-6-8-20/h4-16H,1-3H3,(H,25,27)(H,26,28)
InChIKeyYYYNNYAENMVURU-UHFFFAOYSA-N
XLogP4.85
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.85
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

4-tert-butyl-N-(4-phenoxyphenyl)benzamide
CID 675709
4-[4-(benzamidocarbamoyl)phenoxy]-N'-benzoylbenzohydrazide
CID 21231530
bis[4-(4-tert-butylphenoxy)phenyl]methanone
CID 130415299
4-tert-butyl-N-(2-phenoxyphenyl)benzamide
CID 903986
4-(2-methoxypropan-2-yl)-N-(4-phenoxyphenyl)benzamide
CID 142594961
4-tert-butyl-N'-[2-(4-tert-butylphenoxy)acetyl]benzohydrazide
CID 3311747
1-[4-[4-(4-tert-butylphenoxy)phenoxy]phenyl]-2,2-dimethylpropan-1-one
CID 20643573
N'-[3-(4-tert-butylphenoxy)propanoyl]benzohydrazide
CID 9168927
[4-[4-[2-[4-(4-benzoylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-phenylmethanone
CID 70475696
4-tert-butyl-N'-(2,2-diphenylacetyl)benzohydrazide
CID 3260570
[4-[4-[2-[4-[4-[4-[2-(4-benzoylphenoxy)propan-2-yl]phenoxy]benzoyl]phenoxy]propan-2-yl]phenoxy]phenyl]-phenylmethanone
CID 143546093
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 4-tert-butylbenzoate
CID 2489555

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide?
The IUPAC name of 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide (CID 7980024) is 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide.
What is the SMILES notation for 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide?
The canonical SMILES for 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide is CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(Oc3ccccc3)cc2)cc1.
What is the InChIKey of 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide?
The InChIKey is YYYNNYAENMVURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-24(2,3)19-13-9-17(10-14-19)22(27)25-26-23(28)18-11-15-21(16-12-18)29-20-7-5-4-6-8-20/h4-16H,1-3H3,(H,25,27)(H,26,28).
What are the key properties of 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide?
4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide has a molecular weight of 388.47 g/mol, XLogP of 4.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide is sourced from PubChem (CID 7980024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).