2-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
Chemical Structure Depiction of
2-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
2-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
Compound characteristics
| Compound ID: | F994-0138 |
| Compound Name: | 2-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-5,7-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione |
| Molecular Weight: | 374.32 |
| Molecular Formula: | C12 H12 F2 N6 O4 S |
| Smiles: | Cc1c(cnn1C(F)F)S(n1cc2C(N(C)C(N(C)c2n1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2213 |
| logD: | -0.2213 |
| logSw: | -1.522 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.705 |
| InChI Key: | YWMIQSHCMBRQQJ-UHFFFAOYSA-N |