3-(4-fluorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-fluorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-fluorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-6912 |
| Compound Name: | 3-(4-fluorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 464.5 |
| Molecular Formula: | C25 H25 F N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CCN1C(c2c(ncn2CC(c2cccc(c2)OC)=O)N(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8104 |
| logD: | 3.8104 |
| logSw: | -4.0678 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.315 |
| InChI Key: | YSILRDNPBNBNCN-UHFFFAOYSA-N |