4-[7-(furan-2-yl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoic acid
Chemical Structure Depiction of
4-[7-(furan-2-yl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoic acid
4-[7-(furan-2-yl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoic acid
Compound characteristics
| Compound ID: | 8019-8506 |
| Compound Name: | 4-[7-(furan-2-yl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoic acid |
| Molecular Weight: | 405.37 |
| Molecular Formula: | C20 H15 N5 O5 |
| Smiles: | CN1C(c2c(nc3N(C(=Cn23)c2ccco2)c2ccc(cc2)C(O)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5202 |
| logD: | 0.125 |
| logSw: | -2.5596 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.329 |
| InChI Key: | RICQARRAHFDUQX-UHFFFAOYSA-N |