N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L090-2027 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H17 N5 O4 |
| Smiles: | CN1C=Nc2c(C(NCc3ccc4c(c3)OCO4)=O)nn(c3ccccc3)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.3377 |
| logD: | 1.3377 |
| logSw: | -2.1371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.855 |
| InChI Key: | SNGMXPFTGYRPIZ-UHFFFAOYSA-N |