2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide

C23H20N4O2 — CID 171053517

IUPAC2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide
SMILESNNC(=O)Cn1c(-c2ccc(O)cc2)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C23H20N4O2/c24-26-20(29)15-27-22(17-9-5-2-6-10-17)21(16-7-3-1-4-8-16)25-23(27)18-11-13-19(28)14-12-18/h1-14,28H,15,24H2,(H,26,29)
InChIKeyHHYWDWAGDIOJPZ-UHFFFAOYSA-N
MW384.44 g/mol
LogP3.58
Rot. Bonds5

About 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide

2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide (PubChem CID 171053517) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide.

Molecular Properties

Compound Name2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide
PubChem CID171053517
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide
SMILESNNC(=O)Cn1c(-c2ccc(O)cc2)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C23H20N4O2/c24-26-20(29)15-27-22(17-9-5-2-6-10-17)21(16-7-3-1-4-8-16)25-23(27)18-11-13-19(28)14-12-18/h1-14,28H,15,24H2,(H,26,29)
InChIKeyHHYWDWAGDIOJPZ-UHFFFAOYSA-N
XLogP3.58
TPSA93.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide?
The IUPAC name of 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide (CID 171053517) is 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide.
What is the SMILES notation for 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide?
The canonical SMILES for 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide is NNC(=O)Cn1c(-c2ccc(O)cc2)nc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide?
The InChIKey is HHYWDWAGDIOJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c24-26-20(29)15-27-22(17-9-5-2-6-10-17)21(16-7-3-1-4-8-16)25-23(27)18-11-13-19(28)14-12-18/h1-14,28H,15,24H2,(H,26,29).
What are the key properties of 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide?
2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide has a molecular weight of 384.44 g/mol, XLogP of 3.58, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-hydroxyphenyl)-4,5-diphenylimidazol-1-yl]acetohydrazide is sourced from PubChem (CID 171053517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).