1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-nitro-1H-pyrazole-3-carboxamide
1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-7725 |
| Compound Name: | 1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C15 H16 N6 O4 S |
| Smiles: | CCCc1cc2C(N(C(C)=Nc2s1)NC(c1c(cn(C)n1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9866 |
| logD: | 0.9639 |
| logSw: | -2.4003 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.125 |
| InChI Key: | KPKZHNUPUQMEST-UHFFFAOYSA-N |