1-benzyl-7-ethyl-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-7-ethyl-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-7-ethyl-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-6050 |
| Compound Name: | 1-benzyl-7-ethyl-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 364.38 |
| Molecular Formula: | C20 H17 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCn1cnc2c1C(N(Cc1ccccc1)C(N2c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8 |
| logD: | 2.8 |
| logSw: | -2.9368 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.271 |
| InChI Key: | CCWXQGHPLDBJBX-UHFFFAOYSA-N |