8-oxo-9-phenyl-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
8-oxo-9-phenyl-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
8-oxo-9-phenyl-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0160 |
| Compound Name: | 8-oxo-9-phenyl-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 421.41 |
| Molecular Formula: | C21 H19 N5 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(C(N)=O)c2c(n1)N(C(N2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3077 |
| logD: | 2.2701 |
| logSw: | -3.2113 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.588 |
| InChI Key: | SHXCIRLITLZCKB-UHFFFAOYSA-N |