8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8012-5419 |
| Compound Name: | 8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 462.29 |
| Molecular Formula: | C20 H17 Cl2 N5 O4 |
| Smiles: | CCn1c2C(N(C)C(N(C)c2nc1Oc1ccc(cc1)Oc1c(cc(cn1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7636 |
| logD: | 4.7636 |
| logSw: | -4.9187 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.391 |
| InChI Key: | ZKLISRHREROKDO-UHFFFAOYSA-N |