| CAS Number | 871217-53-7 |
| Catalog Number | AG019OPV |
| Chemical Name | 3-Cyclopropyl-2-(4-fluorophenyl)-1,3-thiazolidin-4-one |
| IUPAC Name | 3-cyclopropyl-2-(4-fluorophenyl)-1,3-thiazolidin-4-one |
| InChI | InChI=1S/C12H12FNOS/c13-9-3-1-8(2-4-9)12-14(10-5-6-10)11(15)7-16-12/h1-4,10,12H,5-7H2 |
| InChI Key | QIEZFSGRYQGRTO-UHFFFAOYSA-N |
| MDL Number | MFCD07348588 |
| Molecular Formula | C12H12FNOS |
| Molecular Weight | 237.2932 |
| SMILES | FC1=CC=C(C2N(C3CC3)C(=O)CS2)C=C1 |
| Synonyms | 3-cyclopropyl-2-(4-fluorophenyl)-1,3-thiazolidin-4-one,
871217-53-7,
CTK7H4624,
AKOS033030290,
MCULE-3709054882,
NE37544,
EN300-14829,
AR-685/43306305,
Z108566716,
AC1Q4M8T,
QIEZFSGRYQGRTO-UHFFFAOYSA-N,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.062363g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.3g/mol |
| Monoisotopic Mass | 237.062363g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 45.6Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number