7-[(4-fluorophenyl)methyl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7706-0435 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C19 H24 F N5 O2 |
| Smiles: | CCCCCCNc1nc2c(C(NC(N2C)=O)=O)n1Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.1528 |
| logD: | 4.1527 |
| logSw: | -3.9862 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.873 |
| InChI Key: | OAIUOGZDNIHLMG-UHFFFAOYSA-N |