4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol

C26H20N2O2 — CID 135507476

IUPAC4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol
SMILESOc1ccc(/N=C/c2ccc(-c3ccc(/C=N/c4ccc(O)cc4)cc3)cc2)cc1
InChIInChI=1S/C26H20N2O2/c29-25-13-9-23(10-14-25)27-17-19-1-5-21(6-2-19)22-7-3-20(4-8-22)18-28-24-11-15-26(30)16-12-24/h1-18,29-30H/b27-17+,28-18+
InChIKeyVMORMMZSPOUYLE-XUIWWLCJSA-N
MW392.46 g/mol
LogP6.27
Rot. Bonds5

About 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol

4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol (PubChem CID 135507476) has the molecular formula C26H20N2O2 and a molecular weight of 392.46 g/mol. Its IUPAC name is 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol.

Molecular Properties

Compound Name4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol
PubChem CID135507476
Molecular FormulaC26H20N2O2
Molecular Weight392.46 g/mol
Exact Mass392.15
IUPAC Name4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol
SMILESOc1ccc(/N=C/c2ccc(-c3ccc(/C=N/c4ccc(O)cc4)cc3)cc2)cc1
InChIInChI=1S/C26H20N2O2/c29-25-13-9-23(10-14-25)27-17-19-1-5-21(6-2-19)22-7-3-20(4-8-22)18-28-24-11-15-26(30)16-12-24/h1-18,29-30H/b27-17+,28-18+
InChIKeyVMORMMZSPOUYLE-XUIWWLCJSA-N
XLogP6.27
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 56.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol 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 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol?
The IUPAC name of 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol (CID 135507476) is 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol.
What is the SMILES notation for 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol?
The canonical SMILES for 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol is Oc1ccc(/N=C/c2ccc(-c3ccc(/C=N/c4ccc(O)cc4)cc3)cc2)cc1.
What is the InChIKey of 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol?
The InChIKey is VMORMMZSPOUYLE-XUIWWLCJSA-N. The full InChI is InChI=1S/C26H20N2O2/c29-25-13-9-23(10-14-25)27-17-19-1-5-21(6-2-19)22-7-3-20(4-8-22)18-28-24-11-15-26(30)16-12-24/h1-18,29-30H/b27-17+,28-18+.
What are the key properties of 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol?
4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol has a molecular weight of 392.46 g/mol, XLogP of 6.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[4-[(4-hydroxyphenyl)iminomethyl]phenyl]phenyl]methylideneamino]phenol is sourced from PubChem (CID 135507476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).