9-(difluoromethyl)-2-(3,4-dimethoxyphenyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-(difluoromethyl)-2-(3,4-dimethoxyphenyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
9-(difluoromethyl)-2-(3,4-dimethoxyphenyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0145 |
| Compound Name: | 9-(difluoromethyl)-2-(3,4-dimethoxyphenyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C20 H15 F2 N5 O2 S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(c4ccc(c(c4)OC)OC)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1795 |
| logD: | 4.1671 |
| logSw: | -4.6503 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.481 |
| InChI Key: | HXWUGZAAVRHESS-UHFFFAOYSA-N |