4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide

C24H32N2O6 — CID 24677365

IUPAC4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C24H32N2O6/c1-5-6-7-8-13-32-19-11-9-18(10-12-19)24(28)26-25-22(27)16-17-14-20(29-2)23(31-4)21(15-17)30-3/h9-12,14-15H,5-8,13,16H2,1-4H3,(H,25,27)(H,26,28)
InChIKeySUGBLPQTRQYZAN-UHFFFAOYSA-N
MW444.53 g/mol
LogP3.68
Rot. Bonds12

About 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide

4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide (PubChem CID 24677365) has the molecular formula C24H32N2O6 and a molecular weight of 444.53 g/mol. Its IUPAC name is 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide
PubChem CID24677365
Molecular FormulaC24H32N2O6
Molecular Weight444.53 g/mol
Exact Mass444.23
IUPAC Name4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C24H32N2O6/c1-5-6-7-8-13-32-19-11-9-18(10-12-19)24(28)26-25-22(27)16-17-14-20(29-2)23(31-4)21(15-17)30-3/h9-12,14-15H,5-8,13,16H2,1-4H3,(H,25,27)(H,26,28)
InChIKeySUGBLPQTRQYZAN-UHFFFAOYSA-N
XLogP3.68
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.53
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 4936338
N'-(4-hexoxybenzoyl)-2,5-dimethoxybenzohydrazide
CID 24677398
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
4-butoxy-3-methoxy-N'-[3-(3,4,5-trimethoxyphenyl)propanoyl]benzohydrazide
CID 30317919
2-methoxy-N'-(4-octoxybenzoyl)benzohydrazide
CID 139600143
N'-butanoyl-4-butoxybenzohydrazide
CID 17340318
4-(4-docosoxyphenyl)-N'-[4-(4-docosoxyphenyl)benzoyl]benzohydrazide
CID 102344080
4-hexoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
CID 26163669
4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide
CID 24677420
4-hexoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952932
4-[(4-methoxyphenyl)diazenyl]-N'-(4-octoxybenzoyl)benzohydrazide
CID 137270173
N'-[2-(2,6-dimethylphenoxy)acetyl]-4-heptoxybenzohydrazide
CID 4950737

Frequently Asked Questions

What is the IUPAC name of 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide?
The IUPAC name of 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide (CID 24677365) is 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide.
What is the SMILES notation for 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide?
The canonical SMILES for 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide is CCCCCCOc1ccc(C(=O)NNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide?
The InChIKey is SUGBLPQTRQYZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O6/c1-5-6-7-8-13-32-19-11-9-18(10-12-19)24(28)26-25-22(27)16-17-14-20(29-2)23(31-4)21(15-17)30-3/h9-12,14-15H,5-8,13,16H2,1-4H3,(H,25,27)(H,26,28).
What are the key properties of 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide?
4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide has a molecular weight of 444.53 g/mol, XLogP of 3.68, 12 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide is sourced from PubChem (CID 24677365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).