7-[(2-fluorophenyl)methyl]-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-fluorophenyl)methyl]-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-fluorophenyl)methyl]-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D226-0089 |
| Compound Name: | 7-[(2-fluorophenyl)methyl]-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 371.41 |
| Molecular Formula: | C19 H22 F N5 O2 |
| Smiles: | CC1CCCN(C1)c1nc2c(C(NC(N2C)=O)=O)n1Cc1ccccc1F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6004 |
| logD: | 3.6003 |
| logSw: | -3.6714 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.545 |
| InChI Key: | MPKFXHIMPMIXHL-LBPRGKRZSA-N |