7-[(3-fluorophenyl)methyl]-1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(3-fluorophenyl)methyl]-1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione
7-[(3-fluorophenyl)methyl]-1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D114-0041 |
| Compound Name: | 7-[(3-fluorophenyl)methyl]-1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C20 H25 F N6 O3 |
| Smiles: | CN1C(c2c(nc(NCCN3CCOCC3)n2Cc2cccc(c2)F)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9963 |
| logD: | 1.3661 |
| logSw: | -2.5802 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.579 |
| InChI Key: | PNHISGGKLBFDII-UHFFFAOYSA-N |