9-(difluoromethyl)-2-(1,3-dimethyl-1H-pyrazol-5-yl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-(difluoromethyl)-2-(1,3-dimethyl-1H-pyrazol-5-yl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
9-(difluoromethyl)-2-(1,3-dimethyl-1H-pyrazol-5-yl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y501-1787 |
| Compound Name: | 9-(difluoromethyl)-2-(1,3-dimethyl-1H-pyrazol-5-yl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 447.47 |
| Molecular Formula: | C22 H15 F2 N7 S |
| Smiles: | Cc1cc(c2nc3c4c(c5c(cc(C(F)F)nc5s4)c4ccccc4)ncn3n2)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0603 |
| logD: | 4.054 |
| logSw: | -4.4366 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.271 |
| InChI Key: | DTWUVINEEBRRLN-UHFFFAOYSA-N |