2-(4-bromobenzene-1-sulfonyl)-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
Chemical Structure Depiction of
2-(4-bromobenzene-1-sulfonyl)-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
2-(4-bromobenzene-1-sulfonyl)-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
Compound characteristics
| Compound ID: | F994-0089 |
| Compound Name: | 2-(4-bromobenzene-1-sulfonyl)-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione |
| Molecular Weight: | 399.22 |
| Molecular Formula: | C13 H11 Br N4 O4 S |
| Smiles: | CN1C(c2cn(nc2N(C)C1=O)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0563 |
| logD: | 2.0563 |
| logSw: | -2.5996 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.119 |
| InChI Key: | SUVHVRAVGSBTMA-UHFFFAOYSA-N |