1-[(2-fluorophenyl)methyl]-7-[(4-methoxyphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-[(2-fluorophenyl)methyl]-7-[(4-methoxyphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
1-[(2-fluorophenyl)methyl]-7-[(4-methoxyphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-4624 |
| Compound Name: | 1-[(2-fluorophenyl)methyl]-7-[(4-methoxyphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C29 H27 F N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(Cc2ccccc2F)C(c2c1ncn2Cc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4137 |
| logD: | 5.4137 |
| logSw: | -5.4213 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.818 |
| InChI Key: | WQMLAMPJCPCBNH-UHFFFAOYSA-N |