2-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide
Chemical Structure Depiction of
2-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide
2-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide
Compound characteristics
| Compound ID: | Y500-3009 |
| Compound Name: | 2-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide |
| Molecular Weight: | 445.85 |
| Molecular Formula: | C17 H15 Cl F3 N5 O2 S |
| Smiles: | CC1=Nc2c(C(N1NC(Cn1c(C)c(c(C(F)(F)F)n1)[Cl])=O)=O)c1CCCc1s2 |
| Stereo: | ACHIRAL |
| logP: | 2.1029 |
| logD: | 2.1029 |
| logSw: | -3.6312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.509 |
| InChI Key: | YSRNDJNAFOOEIO-UHFFFAOYSA-N |