8-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8008-5963 |
| Compound Name: | 8-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 288.31 |
| Molecular Formula: | C13 H16 N6 O2 |
| Smiles: | Cc1cc(C)n(c2nc3c(C(N(C)C(N3C)=O)=O)n2C)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.876 |
| logD: | 0.8665 |
| logSw: | -1.0532 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.198 |
| InChI Key: | MYDGNXVFYRZQHD-UHFFFAOYSA-N |