| CAS Number | 1817698-21-7 |
| Catalog Number | AG01EO6S |
| Chemical Name | BDP5290 |
| IUPAC Name | 4-chloro-1-piperidin-4-yl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyrazole-3-carboxamide |
| InChI | InChI=1S/C17H18ClN7O/c18-12-10-25(11-4-7-19-8-5-11)24-15(12)17(26)22-14-9-21-23-16(14)13-3-1-2-6-20-13/h1-3,6,9-11,19H,4-5,7-8H2,(H,21,23)(H,22,26) |
| InChI Key | BPVZKUXLOLRECL-UHFFFAOYSA-N |
| MDL Number | MFCD28386213 |
| Molecular Formula | C17H18ClN7O |
| Molecular Weight | 371.8241 |
| SMILES | C1NCCC(N2N=C(C(NC3C(C4=NC=CC=C4)=NNC=3)=O)C(Cl)=C2)C1 |
| Synonyms | 4-chloro-1-(4-piperidyl)-N-(5-(2-pyridyl)-1H-pyrazol-4-yl)pyrazole-3-carboxamide,
BDP00005290,
BDP5290,
BDP5290,
1817698-21-7,
4-Chloro-1-(Piperidin-4-Yl)-N-[3-(Pyridin-2-Yl)-1h-Pyrazol-4-Yl]-1h-Pyrazole-3-Carboxamide,
CS-8133,
HY-12437,
A16966,
4-chloro-1-(4-piperidyl)-N-[5-(2-pyridyl)-1h-pyrazol-4-yl]pyrazole-3-carboxamide,
3FV,
27548-93-2,
|
| Complexity | 490 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 371.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 371.829g/mol |
| Monoisotopic Mass | 371.126g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 101A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number