ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-6-hydroxy-4-methyl-7-oxopteridin-8(7H)-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-6-hydroxy-4-methyl-7-oxopteridin-8(7H)-yl}benzoate
ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-6-hydroxy-4-methyl-7-oxopteridin-8(7H)-yl}benzoate
Compound characteristics
| Compound ID: | 8289-0202 |
| Compound Name: | ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-6-hydroxy-4-methyl-7-oxopteridin-8(7H)-yl}benzoate |
| Molecular Weight: | 489.49 |
| Molecular Formula: | C25 H23 N5 O6 |
| Smiles: | CCOC(c1ccc(cc1)Nc1nc(C)c2c(n1)N(C(C(=N2)O)=O)c1ccc(cc1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3091 |
| logD: | 2.6031 |
| logSw: | -4.1237 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.829 |
| InChI Key: | PYCIGVVTXKECOO-UHFFFAOYSA-N |