4-Methyl-2-[(2-thienylmethylene)amino]phenol
Basic information
- CAS
1164508-14-8- Standard SMILES
Cc1ccc(O)c(N=Cc2cccs2)c1- InChIKey
NLJMPZLJRDIZQW-UHFFFAOYSA-N- Molecular formula
- C12H11NOS
- Average molar mass
- 217.29 g/mol
- Monoisotopic mass
- 217.05613515
Names & identifiers
- Preferred name
- 4-Methyl-2-[(2-thienylmethylene)amino]phenol
- IUPAC
- 4-methyl-2-(thiophen-2-ylmethylideneamino)phenol
Names & synonyms
4-methyl-2-[(2-thienylmethylene)amino]phenol1164508-14-84-Methyl-2-[(E)-(2-thienylmethylene)amino]phenol4-methyl-2-(thiophen-2-ylmethylideneamino)phenolMLS000704505CHEMBL1378427CHEMBL3190603DTXSID901238647HMS2584J06STK044666AKOS000488631SMR000231464
Show more names
ST45035818MLS-0223540.0001AN-329/405293752-((1E)-2-(2-thienyl)-1-azavinyl)-4-methylphenol4-methyl-2-{[(E)-thiophen-2-ylmethylidene]amino}phenolPhenol, 4-methyl-2-[(E)-(2-thienylmethylene)amino]-4-Methyl-2-{(E)-[(thiophen-2-yl)methylidene]amino}phenol
Database identifiers
- CAS
1164508-14-8- PubChem CID
- 833010
- DTXSID
DTXSID901238647- ChEMBL
CHEMBL1378427、CHEMBL3190603
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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