2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y501-1826 |
| Compound Name: | 2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 495.94 |
| Molecular Formula: | C23 H16 Cl F2 N7 S |
| Smiles: | Cc1c(c(C)n(Cc2nc3c4c(c5c(cc(C(F)F)nc5s4)c4ccccc4)ncn3n2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6759 |
| logD: | 4.6628 |
| logSw: | -5.2627 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.493 |
| InChI Key: | JYKIKECKJOWQBH-UHFFFAOYSA-N |