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

C10H8N2OS — CID 1205614

IUPAC4-(1,3-thiazol-2-yliminomethyl)phenol
SMILESOc1ccc(C=Nc2nccs2)cc1
InChIInChI=1S/C10H8N2OS/c13-9-3-1-8(2-4-9)7-12-10-11-5-6-14-10/h1-7,13H
InChIKeyLEXABYIVSICYNZ-UHFFFAOYSA-N
MW204.25 g/mol
LogP2.60
Rot. Bonds2

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

4-(1,3-thiazol-2-yliminomethyl)phenol (PubChem CID 1205614) has the molecular formula C10H8N2OS and a molecular weight of 204.25 g/mol. Its IUPAC name is 4-(1,3-thiazol-2-yliminomethyl)phenol.

Molecular Properties

Compound Name4-(1,3-thiazol-2-yliminomethyl)phenol
PubChem CID1205614
Molecular FormulaC10H8N2OS
Molecular Weight204.25 g/mol
Exact Mass204.04
IUPAC Name4-(1,3-thiazol-2-yliminomethyl)phenol
SMILESOc1ccc(C=Nc2nccs2)cc1
InChIInChI=1S/C10H8N2OS/c13-9-3-1-8(2-4-9)7-12-10-11-5-6-14-10/h1-7,13H
InChIKeyLEXABYIVSICYNZ-UHFFFAOYSA-N
XLogP2.60
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(1,3-thiazol-2-yliminomethyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-Thiazolylazo)-p-cresol
CID 137226
Thiourea, N-(2-(2-hydroxyphenyl)ethyl)-N'-2-thiazolyl-
CID 3001170
1-(Thiazol-2-yliminomethyl)-naphthalen-2-ol
CID 135443142
1-[(2-Thiazolylimino)methyl]-2-naphthalenol
CID 673424
(2E,5E)-5-[(4-hydroxyphenyl)methylidene]-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-4-one
CID 135783301
4-((Thiazol-2-ylimino)methyl)benzene-1,3-diol
CID 394207
(4-Methoxy-benzylidene)-thiazol-2-yl-amine
CID 9579382
Thiourea, N-[2-(4-hydroxyphenyl)ethyl]-N'-2-thiazolyl-
CID 3003036
(2E,5Z)-3-allyl-5-(4-hydroxybenzylidene)-2-(thiazol-2-ylimino)thiazolidin-4-one
CID 5532165
Phenol, 4-[(2-thiazolylimino)methyl]-
CID 135477882
4-Chloro-2-[(1,3-thiazol-2-ylimino)methyl]phenol
CID 135449186
4-[(E)-thiazol-2-yliminomethyl]benzene-1,3-diol
CID 135499694

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-thiazol-2-yliminomethyl)phenol?
The IUPAC name of 4-(1,3-thiazol-2-yliminomethyl)phenol (CID 1205614) is 4-(1,3-thiazol-2-yliminomethyl)phenol.
What is the SMILES notation for 4-(1,3-thiazol-2-yliminomethyl)phenol?
The canonical SMILES for 4-(1,3-thiazol-2-yliminomethyl)phenol is Oc1ccc(C=Nc2nccs2)cc1.
What is the InChIKey of 4-(1,3-thiazol-2-yliminomethyl)phenol?
The InChIKey is LEXABYIVSICYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2OS/c13-9-3-1-8(2-4-9)7-12-10-11-5-6-14-10/h1-7,13H.
What are the key properties of 4-(1,3-thiazol-2-yliminomethyl)phenol?
4-(1,3-thiazol-2-yliminomethyl)phenol has a molecular weight of 204.25 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-thiazol-2-yliminomethyl)phenol is sourced from PubChem (CID 1205614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).