| CAS Number | 401567-36-0 |
| Catalog Number | AG018GEG(AGN-PC-0WBQ77) |
| Chemical Name | 6-Fluoro-2-(piperazin-1-yl)benzo[d]thiazole |
| IUPAC Name | 6-fluoro-2-piperazin-1-yl-1,3-benzothiazole |
| InChI | InChI=1S/C11H12FN3S/c12-8-1-2-9-10(7-8)16-11(14-9)15-5-3-13-4-6-15/h1-2,7,13H,3-6H2 |
| InChI Key | SAAAUUMNBLXAFT-UHFFFAOYSA-N |
| MDL Number | MFCD09743163 |
| Molecular Formula | C11H12FN3S |
| Molecular Weight | 237.2965 |
| SMILES | FC1=CC2=C(N=C(N3CCNCC3)S2)C=C1 |
| Synonyms | 401567-36-0,
6-fluoro-2-(piperazin-1-yl)benzo[d]thiazole,
6-Fluoro-2-piperazin-1-yl-1,3-benzothiazole,
F2146-0079,
6-fluoro-2-(piperazin-1-yl)-benzothiazole,
SCHEMBL2710695,
MFCD09743163,
ZINC11919932,
AKOS005207926,
MCULE-5478984709,
CS-0047260,
L-3790,
6-fluoro-2-(piperazin-1-yl)-1,3-benzothiazole,
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| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.296g/mol |
| Monoisotopic Mass | 237.074g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 56.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number