| CAS Number | 1416712-80-5 |
| Catalog Number | AG019EX8(AGN-PC-0WG46B) |
| Chemical Name | 5-bromo-1-(oxan-2-yl)pyrazolo[4,3-b]pyridine |
| IUPAC Name | 5-bromo-1-(oxan-2-yl)pyrazolo[4,3-b]pyridine |
| InChI | InChI=1S/C11H12BrN3O/c12-10-5-4-9-8(14-10)7-13-15(9)11-3-1-2-6-16-11/h4-5,7,11H,1-3,6H2 |
| InChI Key | PBDUEFMOFFHFST-UHFFFAOYSA-N |
| MDL Number | MFCD22689847 |
| Molecular Formula | C11H12BrN3O |
| Molecular Weight | 282.1365 |
| SMILES | BrC1=CC=C2C(=N1)C=NN2C2OCCCC2 |
| Synonyms | 1416712-80-5,
5-Bromo-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[4,3-b]pyridine,
5-bromo-1-(oxan-2-yl)pyrazolo[4,3-b]pyridine,
SCHEMBL18260790,
MFCD22689847,
AS-54968,
CS-0037610,
5-bromo-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[4,3-b]pyridine, 95% - 1G 1g,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.016g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.141g/mol |
| Monoisotopic Mass | 281.016g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number