1-cyclohexyl-3-(3,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclohexyl-3-(3,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1-cyclohexyl-3-(3,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0458 |
| Compound Name: | 1-cyclohexyl-3-(3,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 454.45 |
| Molecular Formula: | C24 H21 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)N1C(c2c(ncn2Cc2cccc(c2)F)N(C1=O)c1ccc(c(c1)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4727 |
| logD: | 4.4727 |
| logSw: | -4.4285 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.496 |
| InChI Key: | MLPDWRSJGQTNOW-UHFFFAOYSA-N |