| CAS Number | 1342777-72-3 |
| Catalog Number | AG01ARYG(AGN-PC-0WCNTY) |
| Chemical Name | 1-(Benzo[d]thiazol-2-yl)azetidin-3-ol |
| IUPAC Name | 1-(1,3-benzothiazol-2-yl)azetidin-3-ol |
| InChI | InChI=1S/C10H10N2OS/c13-7-5-12(6-7)10-11-8-3-1-2-4-9(8)14-10/h1-4,7,13H,5-6H2 |
| InChI Key | NTTYQEGRKKQHIB-UHFFFAOYSA-N |
| MDL Number | MFCD18266127 |
| Molecular Formula | C10H10N2OS |
| Molecular Weight | 206.2642 |
| SMILES | OC1CN(C1)C2SC3C(=CC=CC=3)N=2 |
| Synonyms | 1-(benzo[d]thiazol-2-yl)azetidin-3-ol,
1342777-72-3,
ZINC57838983,
AKOS008179385,
MCULE-6169261591,
F2145-0975,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.263g/mol |
| Monoisotopic Mass | 206.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number