4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide

C29H26N2O4 — CID 4956671

IUPAC4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)c1ccc(OCCc2ccccc2)cc1
InChIInChI=1S/C29H26N2O4/c32-28(21-35-27-15-11-24(12-16-27)23-9-5-2-6-10-23)30-31-29(33)25-13-17-26(18-14-25)34-20-19-22-7-3-1-4-8-22/h1-18H,19-21H2,(H,30,32)(H,31,33)
InChIKeyMYIICOGOYRMKNV-UHFFFAOYSA-N
MW466.54 g/mol
LogP4.82
Rot. Bonds9

About 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide

4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide (PubChem CID 4956671) has the molecular formula C29H26N2O4 and a molecular weight of 466.54 g/mol. Its IUPAC name is 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide
PubChem CID4956671
Molecular FormulaC29H26N2O4
Molecular Weight466.54 g/mol
Exact Mass466.19
IUPAC Name4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)c1ccc(OCCc2ccccc2)cc1
InChIInChI=1S/C29H26N2O4/c32-28(21-35-27-15-11-24(12-16-27)23-9-5-2-6-10-23)30-31-29(33)25-13-17-26(18-14-25)34-20-19-22-7-3-1-4-8-22/h1-18H,19-21H2,(H,30,32)(H,31,33)
InChIKeyMYIICOGOYRMKNV-UHFFFAOYSA-N
XLogP4.82
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.54
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-methoxyphenoxy)acetyl]-4-(2-phenylethoxy)benzohydrazide
CID 4956591
N'-(4-chlorobenzoyl)-4-(2-phenylethoxy)benzohydrazide
CID 4956611
4-(2-phenoxyethoxy)-N'-(3-phenylpropanoyl)benzohydrazide
CID 4952848
N-benzyl-4-oxo-4-[2-[4-(2-phenylethoxy)benzoyl]hydrazinyl]butanamide
CID 4956632
N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134452
4-(2-phenoxyethoxy)-N'-(2-phenylacetyl)benzohydrazide
CID 4952867
N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide
CID 3096307
2-chloro-N'-[4-(2-phenylethoxy)benzoyl]benzohydrazide
CID 4956612
N'-[2-(4-ethylphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
CID 4952907
N'-[4-(3-methylbutoxy)benzoyl]-4-(2-phenylethoxy)benzohydrazide
CID 4956685
2-bromo-N'-[4-(2-phenylethoxy)benzoyl]benzohydrazide
CID 4956682
N'-[2-(4-butan-2-ylphenoxy)acetyl]-4-phenylbenzohydrazide
CID 2965039

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide?
The IUPAC name of 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide (CID 4956671) is 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide is O=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)c1ccc(OCCc2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide?
The InChIKey is MYIICOGOYRMKNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2O4/c32-28(21-35-27-15-11-24(12-16-27)23-9-5-2-6-10-23)30-31-29(33)25-13-17-26(18-14-25)34-20-19-22-7-3-1-4-8-22/h1-18H,19-21H2,(H,30,32)(H,31,33).
What are the key properties of 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide?
4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide has a molecular weight of 466.54 g/mol, XLogP of 4.82, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 4956671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).