methyl 2-(2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
methyl 2-(2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F462-0313 |
| Compound Name: | methyl 2-(2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate |
| Molecular Weight: | 463.42 |
| Molecular Formula: | C23 H18 F N5 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C(N(Cc2ccc(cc2)F)C(c2c1nccn2)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4879 |
| logD: | 2.4769 |
| logSw: | -2.9728 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.132 |
| InChI Key: | DKFMKCHTRZWBPJ-UHFFFAOYSA-N |