7-[(4-fluorophenyl)methyl]-3-(4-methylphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-3-(4-methylphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-3-(4-methylphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-6655 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-3-(4-methylphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C23 H23 F N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CN1C(c2c(ncn2Cc2ccc(cc2)F)N(C1=O)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0427 |
| logD: | 4.0427 |
| logSw: | -4.0529 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.546 |
| InChI Key: | QKXWOHICSPGXKW-UHFFFAOYSA-N |