1-cyclohexyl-7-[(3-fluorophenyl)methyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclohexyl-7-[(3-fluorophenyl)methyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
1-cyclohexyl-7-[(3-fluorophenyl)methyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0452 |
| Compound Name: | 1-cyclohexyl-7-[(3-fluorophenyl)methyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C25 H25 F N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1N1C(N(C2CCCCC2)C(c2c1ncn2Cc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5328 |
| logD: | 4.5328 |
| logSw: | -4.3712 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.195 |
| InChI Key: | QTAXTZJMKQMEFZ-UHFFFAOYSA-N |