1-benzyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-7483 |
| Compound Name: | 1-benzyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C26 H21 F N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cn2cnc3c2C(N(Cc2ccccc2)C(N3c2cccc(c2)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4516 |
| logD: | 4.4516 |
| logSw: | -4.4369 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | SSMWAFPOBPBNTF-UHFFFAOYSA-N |