| CAS Number | 25962-68-9 |
| Catalog Number | AG019VR2(AGN-PC-0WCOHF) |
| Chemical Name | 2-chloro-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide |
| IUPAC Name | 2-chloro-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide |
| InChI | InChI=1S/C10H8ClN3OS/c11-6-8(15)12-10-13-9(14-16-10)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,13,14,15) |
| InChI Key | DSELUSKAJCJQHM-UHFFFAOYSA-N |
| MDL Number | MFCD06409307 |
| Molecular Formula | C10H8ClN3OS |
| Molecular Weight | 253.7080 |
| SMILES | ClCC(NC1SN=C(C2=CC=CC=C2)N=1)=O |
| Synonyms | 2-chloro-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide,
25962-68-9,
MFCD06409307,
ZINC39440124,
AKOS000813777,
MCULE-8810230934,
L-3511,
F9995-0358,
|
| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.704g/mol |
| Monoisotopic Mass | 253.008g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 83.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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Certificate of Analysis
Lot Number