4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol

C11H10N2O2S — CID 935743

IUPAC4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol
SMILESCOc1ccc(O)c(C=Nc2nccs2)c1
InChIInChI=1S/C11H10N2O2S/c1-15-9-2-3-10(14)8(6-9)7-13-11-12-4-5-16-11/h2-7,14H,1H3
InChIKeyWOUUVMSHQLGHPS-UHFFFAOYSA-N
MW234.28 g/mol
LogP2.61
Rot. Bonds3

About 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol

4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol (PubChem CID 935743) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol.

Molecular Properties

Compound Name4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol
PubChem CID935743
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC Name4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol
SMILESCOc1ccc(O)c(C=Nc2nccs2)c1
InChIInChI=1S/C11H10N2O2S/c1-15-9-2-3-10(14)8(6-9)7-13-11-12-4-5-16-11/h2-7,14H,1H3
InChIKeyWOUUVMSHQLGHPS-UHFFFAOYSA-N
XLogP2.61
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(3H-benzimidazol-5-yliminomethyl)-4-methoxyphenol
CID 137122842
4-methoxy-2-[(4-phenoxyphenyl)iminomethyl]phenol
CID 135681255
2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]benzonitrile
CID 2768021
1-[3-[(2-hydroxy-5-methoxyphenyl)methylideneamino]phenyl]ethanone
CID 135595395
2-[[(2-hydroxy-5-methoxyphenyl)methylideneamino]oxymethoxyiminomethyl]-4-methoxyphenol
CID 136914415
4-[(2-hydroxy-5-methoxyphenyl)methylideneamino]benzonitrile
CID 1040051
4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol
CID 135787695
4-methoxy-2-[(3-methylsulfonylphenyl)iminomethyl]phenol
CID 135855363
dimethyl 5-[(2-hydroxy-5-methoxyphenyl)methylideneamino]benzene-1,3-dicarboxylate
CID 135595457
2-[(3-chloro-4-methoxyphenyl)iminomethyl]-4-methoxyphenol
CID 135595566
2-[(2-fluoro-5-methylphenyl)iminomethyl]-4-methoxyphenol
CID 135595645
3-[(2-hydroxy-5-methoxyphenyl)methylideneamino]-N-methylbenzamide
CID 135758537

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol?
The IUPAC name of 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol (CID 935743) is 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol.
What is the SMILES notation for 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol?
The canonical SMILES for 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol is COc1ccc(O)c(C=Nc2nccs2)c1.
What is the InChIKey of 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol?
The InChIKey is WOUUVMSHQLGHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2S/c1-15-9-2-3-10(14)8(6-9)7-13-11-12-4-5-16-11/h2-7,14H,1H3.
What are the key properties of 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol?
4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol has a molecular weight of 234.28 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(1,3-thiazol-2-yliminomethyl)phenol is sourced from PubChem (CID 935743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).