8-bromo-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-bromo-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-bromo-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8010-2616 |
| Compound Name: | 8-bromo-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 259.06 |
| Molecular Formula: | C7 H7 Br N4 O2 |
| Smiles: | CN1C(NC(c2c1nc(n2C)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4619 |
| logD: | 0.4079 |
| logSw: | -1.3779 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.3 |
| InChI Key: | BFCGRDZSZWDOMD-UHFFFAOYSA-N |