1-(2,4-Dihydroxyphenyl)-2-(2-phenyl-4-thiazolyl)ethanone
Basic information
- CAS
51625-78-6- Standard SMILES
O=C(Cc1csc(-c2ccccc2)n1)c1ccc(O)cc1O- InChIKey
FUPBKABSVMOPKD-UHFFFAOYSA-N- Molecular formula
- C17H13NO3S
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.06161445
Names & identifiers
- Preferred name
- 1-(2,4-Dihydroxyphenyl)-2-(2-phenyl-4-thiazolyl)ethanone
- IUPAC
- 1-(2,4-dihydroxyphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanone
Names & synonyms
Oprea1_095545Oprea1_7707941-(2,4-Dihydroxyphenyl)-2-(2-phenyl-4-thiazolyl)ethanoneDTXSID40120229151625-78-61-(2,4-Dihydroxyphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethan-1-one
Database identifiers
- CAS
51625-78-6- PubChem CID
- 5244147
- DTXSID
DTXSID401202291
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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