4-chloro-1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
4-chloro-1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-1282 |
| Compound Name: | 4-chloro-1-methyl-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 433.84 |
| Molecular Formula: | C16 H15 Cl F3 N5 O2 S |
| Smiles: | CCCc1cc2C(N(C(C)=Nc2s1)NC(c1c(c(C(F)(F)F)nn1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5719 |
| logD: | 2.5684 |
| logSw: | -3.8188 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.751 |
| InChI Key: | AHGHJZWXIDMSOZ-UHFFFAOYSA-N |