9-(3-chlorophenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(3-chlorophenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
9-(3-chlorophenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0225 |
| Compound Name: | 9-(3-chlorophenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 371.8 |
| Molecular Formula: | C16 H10 Cl N5 O2 S |
| Smiles: | c1cc(cc(c1)[Cl])N1C(Nc2c(C(N)=O)nc(c3cccs3)nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9761 |
| logD: | 2.7845 |
| logSw: | -3.5843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.629 |
| InChI Key: | PPARYPAXSULOIL-UHFFFAOYSA-N |