Completing data — refresh the page later to see the latest
Basic information
- CAS
1010865-12-9- Standard SMILES
O=C(O)CCN1C(=O)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)SC1=S- InChIKey
RDUVWTFQUMZLIG-UHFFFAOYSA-N- Molecular formula
- C22H16ClN3O3S2
- Average molar mass
- 469.96 g/mol
Names & identifiers
- Preferred name
- 3-[(5Z)-5-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
- English name
- 3-[(5Z)-5-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
- Molecular formula
- C22H16ClN3O3S2
- Molecular weight
- 469.96
Names & synonyms
3-Thiazolidinepropanoic acid, 5-[[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-3-(5-{[3-(4-CHLOROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHYLENE}-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL)PROPANOIC ACID3-[(5Z)-5-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Database identifiers
- CAS
1010865-12-9- PubChem CID
- 2015276
- ChEMBL
CHEMBL1935340- EC Number
- 664-201-0
Properties
Physicochemical properties
- Boiling point
- 693.2 · 693.2±65.0 °C(Predicted)
- Density
- 1.45 · 1.45±0.1 g/cm3(Predicted)
- pka
- 4.11 · 4.11±0.10(Predicted)
- Hazard statements
- 413 · H413
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Hazard statements
- H413
Chemistry & industry
Suppliers5 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…