methyl 4-(2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
methyl 4-(2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F462-0208 |
| Compound Name: | methyl 4-(2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl}acetamido)benzoate |
| Molecular Weight: | 479.88 |
| Molecular Formula: | C23 H18 Cl N5 O5 |
| Smiles: | COC(c1ccc(cc1)NC(CN1C(N(Cc2ccc(cc2)[Cl])C(c2c1nccn2)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4197 |
| logD: | 3.4196 |
| logSw: | -3.8628 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.83 |
| InChI Key: | KAUKYPKIAYUUMD-UHFFFAOYSA-N |