2-[(3-chlorophenoxy)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-[(3-chlorophenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(3-chlorophenoxy)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: | D643-0099 |
| Compound Name: | 2-[(3-chlorophenoxy)methyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 449.84 |
| Molecular Formula: | C19 H11 Cl F3 N5 O S |
| Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(c3nc(COc4cccc(c4)[Cl])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.4745 |
| logD: | 5.4732 |
| logSw: | -6.0386 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.71 |
| InChI Key: | MOLHOQKXYOKQAP-UHFFFAOYSA-N |