3-ethyl-N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-ethyl-N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-ethyl-N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K840-0312 |
| Compound Name: | 3-ethyl-N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 388.4 |
| Molecular Formula: | C17 H16 N4 O5 S |
| Smiles: | CCN1C=Nc2c(C1=O)c(C)c(C(Nc1cc(ccc1OC)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.1843 |
| logD: | 0.801 |
| logSw: | -2.9509 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.643 |
| InChI Key: | JOLXEEBCVSSMFL-UHFFFAOYSA-N |