| CAS Number | 1454555-29-3 |
| Catalog Number | AG01BTE2 |
| Chemical Name | LP-935509 |
| IUPAC Name | propan-2-yl 4-[3-(2-methoxypyridin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxylate |
| InChI | InChI=1S/C20H24N6O3/c1-14(2)29-20(27)25-11-9-24(10-12-25)17-6-8-26-18(23-17)16(13-22-26)15-5-4-7-21-19(15)28-3/h4-8,13-14H,9-12H2,1-3H3 |
| InChI Key | GOOYSJIWTIHOGW-UHFFFAOYSA-N |
| MDL Number | MFCD31689756 |
| Molecular Formula | C20H24N6O3 |
| Molecular Weight | 396.4430 |
| SMILES | O=C(OC(C)C)N1CCN(C2=NC3=C(C=NN3C=C2)C=4C=CC=NC4OC)CC1 |
| Synonyms | LP-935509,
1454555-29-3,
SCHEMBL15261207,
GOOYSJIWTIHOGW-UHFFFAOYSA-N,
4-[3-(2-Methoxy-pyridin-3-yl)-pyrazolo[1,5-a]pyrimidin-5-yl]-piperazine-1-carboxylic acid isopropyl ester,
isopropyl 4-(3-(2-methoxypyridin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl)piperazine-1-carboxylate,
|
| Complexity | 556 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 396.191g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 396.451g/mol |
| Monoisotopic Mass | 396.191g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 85.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number