ethyl 3-{2-[2,4-dioxo-3-(2-phenylethyl)-3,4-dihydropteridin-1(2H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[2,4-dioxo-3-(2-phenylethyl)-3,4-dihydropteridin-1(2H)-yl]acetamido}benzoate
ethyl 3-{2-[2,4-dioxo-3-(2-phenylethyl)-3,4-dihydropteridin-1(2H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F462-0896 |
| Compound Name: | ethyl 3-{2-[2,4-dioxo-3-(2-phenylethyl)-3,4-dihydropteridin-1(2H)-yl]acetamido}benzoate |
| Molecular Weight: | 473.49 |
| Molecular Formula: | C25 H23 N5 O5 |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(N(CCc2ccccc2)C(c2c1nccn2)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6704 |
| logD: | 3.6704 |
| logSw: | -3.7588 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.388 |
| InChI Key: | XFMHLUJQKHZHMH-UHFFFAOYSA-N |