9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0341 |
| Compound Name: | 9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 351.38 |
| Molecular Formula: | C17 H13 N5 O2 S |
| Smiles: | Cc1cccc(c1)N1C(Nc2c(C(N)=O)nc(c3cccs3)nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8351 |
| logD: | 2.8298 |
| logSw: | -3.1832 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.629 |
| InChI Key: | CIBCLNINYWYXEQ-UHFFFAOYSA-N |