2-{5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}-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-{5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}-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: | Y500-9458 |
| Compound Name: | 2-{5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 550.34 |
| Molecular Formula: | C23 H12 Cl2 F3 N5 O2 S |
| Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(c3nc(c4ccc(COc5cccc(c5[Cl])[Cl])o4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 7.1516 |
| logD: | 7.1481 |
| logSw: | -6.9595 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.376 |
| InChI Key: | OPCAPEQGCPWFBB-UHFFFAOYSA-N |