9-(3-chlorophenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(3-chlorophenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
9-(3-chlorophenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0178 |
| Compound Name: | 9-(3-chlorophenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 409.83 |
| Molecular Formula: | C20 H16 Cl N5 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(C(N)=O)c2c(n1)N(C(N2)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9553 |
| logD: | 3.7033 |
| logSw: | -4.3073 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.734 |
| InChI Key: | TVYNOUPVWORBOL-UHFFFAOYSA-N |