N-(2-methoxy-5-nitrophenyl)-3,5-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-3,5-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-methoxy-5-nitrophenyl)-3,5-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K840-0238 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-3,5-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 374.37 |
| Molecular Formula: | C16 H14 N4 O5 S |
| Smiles: | Cc1c2C(N(C)C=Nc2sc1C(Nc1cc(ccc1OC)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5713 |
| logD: | 0.188 |
| logSw: | -2.6135 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.633 |
| InChI Key: | PSOWUZQDKNELSL-UHFFFAOYSA-N |