N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide

C24H24N2O3 — CID 3096307

IUPACN'-(4-butoxybenzoyl)-4-phenylbenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-2-3-17-29-22-15-13-21(14-16-22)24(28)26-25-23(27)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-16H,2-3,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyBIZNTSJUQLYNTR-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.61
Rot. Bonds7

About N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide

N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide (PubChem CID 3096307) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide.

Molecular Properties

Compound NameN'-(4-butoxybenzoyl)-4-phenylbenzohydrazide
PubChem CID3096307
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN'-(4-butoxybenzoyl)-4-phenylbenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-2-3-17-29-22-15-13-21(14-16-22)24(28)26-25-23(27)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-16H,2-3,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyBIZNTSJUQLYNTR-UHFFFAOYSA-N
XLogP4.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(4-docosoxyphenyl)-N'-[4-(4-docosoxyphenyl)benzoyl]benzohydrazide
CID 102344080
N'-[4-(2-ethoxyethoxy)benzoyl]-4-phenylbenzohydrazide
CID 17112731
4-hexoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952932
4-heptoxy-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide
CID 4951042
N-[[(4-phenylbenzoyl)amino]carbamothioyl]-4-propoxybenzamide
CID 4939052
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
N'-(4-pentoxybenzoyl)-4-pyridin-3-ylbenzohydrazide
CID 58858349
4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 4935241
4-butyl-N'-(4-phenylbenzoyl)benzohydrazide
CID 4296967
N'-butanoyl-4-butoxybenzohydrazide
CID 17340318
N'-(4-butoxybenzoyl)-4-methyl-2-phenyl-1,3-thiazole-5-carbohydrazide
CID 7970481
N'-butanoyl-4-(2-phenoxyethoxy)benzohydrazide
CID 17340326

Frequently Asked Questions

What is the IUPAC name of N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide?
The IUPAC name of N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide (CID 3096307) is N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide.
What is the SMILES notation for N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide?
The canonical SMILES for N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide is CCCCOc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide?
The InChIKey is BIZNTSJUQLYNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-2-3-17-29-22-15-13-21(14-16-22)24(28)26-25-23(27)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-16H,2-3,17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide?
N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide has a molecular weight of 388.47 g/mol, XLogP of 4.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide is sourced from PubChem (CID 3096307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).