2-[(2-methoxyphenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(2-methoxyphenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(2-methoxyphenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | D643-0070 |
Compound Name: | 2-[(2-methoxyphenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 445.42 |
Molecular Formula: | C20 H14 F3 N5 O2 S |
Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(c3nc(COc4ccccc4OC)nn3cn1)s2 |
Stereo: | ACHIRAL |
logP: | 4.4256 |
logD: | 4.4243 |
logSw: | -4.6601 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 56.427 |
InChI Key: | GZHJJMYYMCKOPE-UHFFFAOYSA-N |