2-{1-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{1-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{1-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y500-9612 |
| Compound Name: | 2-{1-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C19 H17 F2 N7 S |
| Smiles: | CC(c1nc2c3c(c4c(C)cc(C)nc4s3)ncn2n1)n1c(C)cc(C(F)F)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1595 |
| logD: | 3.0139 |
| logSw: | -3.218 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.316 |
| InChI Key: | YJDALTBIRXIWGB-NSHDSACASA-N |