N-{2-[4,6-dioxo-5,7-di(propan-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidine-2-sulfonyl]-4-methylphenyl}acetamide
Chemical Structure Depiction of
N-{2-[4,6-dioxo-5,7-di(propan-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidine-2-sulfonyl]-4-methylphenyl}acetamide
N-{2-[4,6-dioxo-5,7-di(propan-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidine-2-sulfonyl]-4-methylphenyl}acetamide
Compound characteristics
| Compound ID: | F994-0338 |
| Compound Name: | N-{2-[4,6-dioxo-5,7-di(propan-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidine-2-sulfonyl]-4-methylphenyl}acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C20 H25 N5 O5 S |
| Smiles: | CC(C)N1C(c2cn(nc2N(C(C)C)C1=O)S(c1cc(C)ccc1NC(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8225 |
| logD: | 1.8225 |
| logSw: | -2.5879 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.593 |
| InChI Key: | BBPCCKOGQGVOSV-UHFFFAOYSA-N |