8-chloro-1,3-dimethyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-chloro-1,3-dimethyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
8-chloro-1,3-dimethyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8010-6426 |
| Compound Name: | 8-chloro-1,3-dimethyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 340.85 |
| Molecular Formula: | C16 H25 Cl N4 O2 |
| Smiles: | CCCCCCCCCn1c2C(N(C)C(N(C)c2nc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0374 |
| logD: | 5.0374 |
| logSw: | -4.8969 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.173 |
| InChI Key: | ILPQSDANZQKBNX-UHFFFAOYSA-N |