ethyl ({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate
ethyl ({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | 8015-2888 |
| Compound Name: | ethyl ({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate |
| Molecular Weight: | 406.43 |
| Molecular Formula: | C18 H19 F N4 O4 S |
| Smiles: | CCOC(CSc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3504 |
| logD: | 3.3504 |
| logSw: | -3.3997 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.445 |
| InChI Key: | MPIZQZMYDSMDTG-UHFFFAOYSA-N |