cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol

C18H20CoN2O4 — CID 137286030

IUPACcobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol
SMILESCOc1cccc(/C=N/CC/N=C/c2cccc(OC)c2O)c1O.[Co]
InChIInChI=1S/C18H20N2O4.Co/c1-23-15-7-3-5-13(17(15)21)11-19-9-10-20-12-14-6-4-8-16(24-2)18(14)22;/h3-8,11-12,21-22H,9-10H2,1-2H3;/b19-11+,20-12+;
InChIKeyIORICZNTFDDXCS-BYCVLTJGSA-N
MW387.30 g/mol
LogP2.65
Rot. Bonds7

About cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol

cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol (PubChem CID 137286030) has the molecular formula C18H20CoN2O4 and a molecular weight of 387.30 g/mol. Its IUPAC name is cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol.

Molecular Properties

Compound Namecobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol
PubChem CID137286030
Molecular FormulaC18H20CoN2O4
Molecular Weight387.30 g/mol
Exact Mass387.08
IUPAC Namecobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol
SMILESCOc1cccc(/C=N/CC/N=C/c2cccc(OC)c2O)c1O.[Co]
InChIInChI=1S/C18H20N2O4.Co/c1-23-15-7-3-5-13(17(15)21)11-19-9-10-20-12-14-6-4-8-16(24-2)18(14)22;/h3-8,11-12,21-22H,9-10H2,1-2H3;/b19-11+,20-12+;
InChIKeyIORICZNTFDDXCS-BYCVLTJGSA-N
XLogP2.65
TPSA83.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.30
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol 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 cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol?
The IUPAC name of cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol (CID 137286030) is cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol.
What is the SMILES notation for cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol?
The canonical SMILES for cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol is COc1cccc(/C=N/CC/N=C/c2cccc(OC)c2O)c1O.[Co].
What is the InChIKey of cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol?
The InChIKey is IORICZNTFDDXCS-BYCVLTJGSA-N. The full InChI is InChI=1S/C18H20N2O4.Co/c1-23-15-7-3-5-13(17(15)21)11-19-9-10-20-12-14-6-4-8-16(24-2)18(14)22;/h3-8,11-12,21-22H,9-10H2,1-2H3;/b19-11+,20-12+;.
What are the key properties of cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol?
cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol has a molecular weight of 387.30 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;2-[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyliminomethyl]-6-methoxyphenol is sourced from PubChem (CID 137286030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).