ethyl 4-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
Chemical Structure Depiction of
ethyl 4-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
ethyl 4-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
Compound characteristics
| Compound ID: | 8015-3557 |
| Compound Name: | ethyl 4-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate |
| Molecular Weight: | 452.44 |
| Molecular Formula: | C23 H21 F N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)Oc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9142 |
| logD: | 4.9142 |
| logSw: | -4.5904 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.506 |
| InChI Key: | NOPYHVJFBFZXNG-UHFFFAOYSA-N |