8-[2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-(2,3-dihydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-(2,3-dihydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-[2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-(2,3-dihydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 2516-5064 |
| Compound Name: | 8-[2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-(2,3-dihydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 478.26 |
| Molecular Formula: | C17 H16 Br N7 O5 |
| Smiles: | CN1C(NC(c2c1nc(N/N=C1C(Nc3ccc(cc\13)[Br])=O)n2CC(CO)O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2521 |
| logD: | 1.2501 |
| logSw: | -2.4431 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 132.479 |
| InChI Key: | CLELXBWRSLLSIH-QMMMGPOBSA-N |