8-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8011-8095 |
| Compound Name: | 8-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 437.25 |
| Molecular Formula: | C16 H17 Br N6 O4 |
| Smiles: | CN1C(c2c(nc(N/N=C/c3cc(ccc3O)[Br])n2CCO)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6717 |
| logD: | 2.6648 |
| logSw: | -2.7981 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.202 |
| InChI Key: | XPCCBFGTMGKHKD-UHFFFAOYSA-N |