1-cyclohexyl-3-(3,4-difluorophenyl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclohexyl-3-(3,4-difluorophenyl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
1-cyclohexyl-3-(3,4-difluorophenyl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V015-9799 |
| Compound Name: | 1-cyclohexyl-3-(3,4-difluorophenyl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C20 H22 F2 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)n1cnc2c1C(N(C1CCCCC1)C(N2c1ccc(c(c1)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9284 |
| logD: | 3.9284 |
| logSw: | -3.8917 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.559 |
| InChI Key: | FCSRVRMGYLTRBQ-UHFFFAOYSA-N |