1-butyl-7-[(2-fluorophenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-butyl-7-[(2-fluorophenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
1-butyl-7-[(2-fluorophenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-7450 |
| Compound Name: | 1-butyl-7-[(2-fluorophenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C22 H21 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCCCN1C(c2c(ncn2Cc2ccccc2F)N(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8527 |
| logD: | 3.8527 |
| logSw: | -3.7124 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.524 |
| InChI Key: | IDRAOZCLHBUHJQ-UHFFFAOYSA-N |