8-(benzylamino)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(benzylamino)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(benzylamino)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8015-9156 |
| Compound Name: | 8-(benzylamino)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 313.36 |
| Molecular Formula: | C16 H19 N5 O2 |
| Smiles: | CCn1c2C(N(C)C(N(C)c2nc1NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4006 |
| logD: | 2.3899 |
| logSw: | -2.6403 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.843 |
| InChI Key: | MDYRBYCREIJHDV-UHFFFAOYSA-N |