1,3-dimethyl-8-(morpholin-4-yl)-7-{[3-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-(morpholin-4-yl)-7-{[3-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-(morpholin-4-yl)-7-{[3-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0209 |
| Compound Name: | 1,3-dimethyl-8-(morpholin-4-yl)-7-{[3-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 423.39 |
| Molecular Formula: | C19 H20 F3 N5 O3 |
| Smiles: | CN1C(c2c(nc(N3CCOCC3)n2Cc2cccc(c2)C(F)(F)F)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1373 |
| logD: | 3.1371 |
| logSw: | -3.1901 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.606 |
| InChI Key: | PQWWUSIQPBQMPF-UHFFFAOYSA-N |