7-[(4-fluorophenyl)methyl]-3-methyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-3-methyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-3-methyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C692-0311 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-3-methyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 373.39 |
| Molecular Formula: | C18 H20 F N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(CN1CCOCC1)n2Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.256 |
| logD: | 1.2539 |
| logSw: | -2.2136 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.235 |
| InChI Key: | ZYJJJPAQODXOKP-UHFFFAOYSA-N |