| CAS Number | 1242267-90-8 |
| Catalog Number | AG00IUND(AGN-PC-0WB042) |
| Chemical Name | 6-cyclopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine |
| IUPAC Name | 6-cyclopropyl-4-(trifluoromethyl)-2H-pyrazolo[3,4-b]pyridin-3-amine |
| InChI | InChI=1S/C10H9F3N4/c11-10(12,13)5-3-6(4-1-2-4)15-9-7(5)8(14)16-17-9/h3-4H,1-2H2,(H3,14,15,16,17) |
| InChI Key | SLKOLWASIPNGDL-UHFFFAOYSA-N |
| MDL Number | MFCD16890144 |
| Molecular Formula | C10H9F3N4 |
| Molecular Weight | 242.2005 |
| SMILES | FC(F)(F)C1(=C3(C(=NC(=C1)C2(CC2))NN=C3N)) |
| Synonyms | 6-cyclopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine,
1242267-90-8,
CTK7B6560,
KS-00001Q6J,
ZX-RL001745,
MFCD16890144,
ZINC52508087,
AKOS015840805,
HE-0725,
MCULE-4309839641,
RP13841,
PC200284,
TR-071437,
cyclopropyltrifluoromethylpyrazolobpyridinamine,
J3.578.161G,
6-Cyclopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-3-amine,
|
| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.205g/mol |
| Monoisotopic Mass | 242.078g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number