Basic information
- CAS
57390-81-5- Standard SMILES
CC(=O)Oc1ccc2c(=O)c(-c3csc(-c4ccccc4)n3)coc2c1- InChIKey
VIFUFJQCNUDOFE-UHFFFAOYSA-N- Molecular formula
- C20H13NO4S
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.05652907
Names & identifiers
- Preferred name
- Zinc00630437
- IUPAC
- [4-oxo-3-(2-phenyl-1,3-thiazol-4-yl)chromen-7-yl] acetate
- English name
- 4-oxo-3-(2-phenylthiazol-4-yl)-4H-chromen-7-yl acetate
- Molecular formula
- C20H13NO4S
- Molecular weight
- 363.39
Names & synonyms
57390-81-5ZINC00630437DTXSID80359689RefChem:388663DTXCID503107424-Oxo-3-(2-phenylthiazol-4-yl)-4H-chromen-7-yl acetate4-oxo-3-(2-phenyl-1,3-thiazol-4-yl)-4H-chromen-7-yl acetateOprea1_156910STL512886ACETIC ACID 4-OXO-3-(2-PHENYL-THIAZOL-4-YL)-4H-CHROMEN-7-YL ESTERAKOS0016124403-(2-phenyl-4-thiazolyl)-7-acetoxychromone
Show more names
4H-1-Benzopyran-4-one, 7-(acetyloxy)-3-(2-phenyl-4-thiazolyl)-
EU-0036522SR-01000417069SR-01000417069-14-Oxo-3-(2-phenyl-1,3-thiazol-4-yl)-4H-1-benzopyran-7-yl acetate
Database identifiers
- CAS
57390-81-5- PubChem CID
- 984089
- DTXSID
DTXSID80359689- EC Number
- 166-549-4
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 586
Chemistry & industry
Suppliers2 total
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…