sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol

C16H16CoN2NaO2+ — CID 135544422

IUPACsodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].[Na+]
InChIInChI=1S/C16H16N2O2.Co.Na/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;;/h1-8,11-12,19-20H,9-10H2;;/q;;+1/b17-11+,18-12+;;
InChIKeyMXHOVNWZFSSXIR-SNTCFBDDSA-N
MW350.24 g/mol
LogP-0.36
Rot. Bonds5

About sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol

sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol (PubChem CID 135544422) has the molecular formula C16H16CoN2NaO2+ and a molecular weight of 350.24 g/mol. Its IUPAC name is sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol.

Molecular Properties

Compound Namesodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
PubChem CID135544422
Molecular FormulaC16H16CoN2NaO2+
Molecular Weight350.24 g/mol
Exact Mass350.04
IUPAC Namesodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].[Na+]
InChIInChI=1S/C16H16N2O2.Co.Na/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;;/h1-8,11-12,19-20H,9-10H2;;/q;;+1/b17-11+,18-12+;;
InChIKeyMXHOVNWZFSSXIR-SNTCFBDDSA-N
XLogP-0.36
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.24
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The IUPAC name of sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol (CID 135544422) is sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol.
What is the SMILES notation for sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The canonical SMILES for sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol is Oc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].[Na+].
What is the InChIKey of sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The InChIKey is MXHOVNWZFSSXIR-SNTCFBDDSA-N. The full InChI is InChI=1S/C16H16N2O2.Co.Na/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;;/h1-8,11-12,19-20H,9-10H2;;/q;;+1/b17-11+,18-12+;;.
What are the key properties of sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol has a molecular weight of 350.24 g/mol, XLogP of -0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol is sourced from PubChem (CID 135544422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).