2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-methylpyrido[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-methylpyrido[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-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y509-0770 |
| Compound Name: | 2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 433.87 |
| Molecular Formula: | C18 H14 Cl F2 N7 S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(Cn4c(C)c(c(C)n4)[Cl])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.3604 |
| logD: | 3.3512 |
| logSw: | -3.9939 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.764 |
| InChI Key: | FCGJAPAJJZHUJX-UHFFFAOYSA-N |