2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | Y500-2200 |
| Compound Name: | 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C19 H21 F2 N5 O2 S |
| Smiles: | CC1CCc2c3C(N(C(C)=Nc3sc2C1)NC(Cn1c(C)cc(C(F)F)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8272 |
| logD: | 1.8271 |
| logSw: | -2.3647 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.597 |
| InChI Key: | NBJPLPVABHFIAZ-SECBINFHSA-N |