N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide

C30H22N2O4 — CID 68863701

IUPACN'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide
SMILESO=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(-c2ccccc2)c1
InChIInChI=1S/C30H22N2O4/c33-26-17-16-23(18-24(26)20-10-4-1-5-11-20)29(34)31-32-30(35)28-27(22-14-8-3-9-15-22)25(19-36-28)21-12-6-2-7-13-21/h1-19,33H,(H,31,34)(H,32,35)
InChIKeyQPZXJVVKDGOAEQ-UHFFFAOYSA-N
MW474.52 g/mol
LogP6.06
Rot. Bonds5

About N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide

N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide (PubChem CID 68863701) has the molecular formula C30H22N2O4 and a molecular weight of 474.52 g/mol. Its IUPAC name is N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide
PubChem CID68863701
Molecular FormulaC30H22N2O4
Molecular Weight474.52 g/mol
Exact Mass474.16
IUPAC NameN'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide
SMILESO=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(-c2ccccc2)c1
InChIInChI=1S/C30H22N2O4/c33-26-17-16-23(18-24(26)20-10-4-1-5-11-20)29(34)31-32-30(35)28-27(22-14-8-3-9-15-22)25(19-36-28)21-12-6-2-7-13-21/h1-19,33H,(H,31,34)(H,32,35)
InChIKeyQPZXJVVKDGOAEQ-UHFFFAOYSA-N
XLogP6.06
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.52
LogP ≤ 56.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide?
The IUPAC name of N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide (CID 68863701) is N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide.
What is the SMILES notation for N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide?
The canonical SMILES for N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide is O=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(-c2ccccc2)c1.
What is the InChIKey of N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide?
The InChIKey is QPZXJVVKDGOAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N2O4/c33-26-17-16-23(18-24(26)20-10-4-1-5-11-20)29(34)31-32-30(35)28-27(22-14-8-3-9-15-22)25(19-36-28)21-12-6-2-7-13-21/h1-19,33H,(H,31,34)(H,32,35).
What are the key properties of N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide?
N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide has a molecular weight of 474.52 g/mol, XLogP of 6.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-hydroxy-3-phenylbenzoyl)-3,4-diphenylfuran-2-carbohydrazide is sourced from PubChem (CID 68863701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).