copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide

C20H14CuN4O2 — CID 59971366

IUPACcopper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide
SMILESO=[C-]c1ccccc1/N=N/C(=N\[N-]c1ccccc1O)c1ccccc1.[Cu+2]
InChIInChI=1S/C20H14N4O2.Cu/c25-14-16-10-4-5-11-17(16)21-23-20(15-8-2-1-3-9-15)24-22-18-12-6-7-13-19(18)26;/h1-13H,(H-,21,22,23,24,25,26);/q-2;+2
InChIKeyWANCSDITBWKJLF-UHFFFAOYSA-N
MW405.90 g/mol
LogP5.00
Rot. Bonds5

About copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide

copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide (PubChem CID 59971366) has the molecular formula C20H14CuN4O2 and a molecular weight of 405.90 g/mol. Its IUPAC name is copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide.

Molecular Properties

Compound Namecopper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide
PubChem CID59971366
Molecular FormulaC20H14CuN4O2
Molecular Weight405.90 g/mol
Exact Mass405.04
IUPAC Namecopper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide
SMILESO=[C-]c1ccccc1/N=N/C(=N\[N-]c1ccccc1O)c1ccccc1.[Cu+2]
InChIInChI=1S/C20H14N4O2.Cu/c25-14-16-10-4-5-11-17(16)21-23-20(15-8-2-1-3-9-15)24-22-18-12-6-7-13-19(18)26;/h1-13H,(H-,21,22,23,24,25,26);/q-2;+2
InChIKeyWANCSDITBWKJLF-UHFFFAOYSA-N
XLogP5.00
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.90
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide 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 copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide?
The IUPAC name of copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide (CID 59971366) is copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide.
What is the SMILES notation for copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide?
The canonical SMILES for copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide is O=[C-]c1ccccc1/N=N/C(=N\[N-]c1ccccc1O)c1ccccc1.[Cu+2].
What is the InChIKey of copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide?
The InChIKey is WANCSDITBWKJLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O2.Cu/c25-14-16-10-4-5-11-17(16)21-23-20(15-8-2-1-3-9-15)24-22-18-12-6-7-13-19(18)26;/h1-13H,(H-,21,22,23,24,25,26);/q-2;+2.
What are the key properties of copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide?
copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide has a molecular weight of 405.90 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper (2-hydroxyphenyl)-[(Z)-[[[2-(oxomethyl)phenyl]diazenyl]-phenylmethylidene]amino]azanide is sourced from PubChem (CID 59971366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).