7-methyl-2-{5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-yl}-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-methyl-2-{5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-yl}-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-methyl-2-{5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-yl}-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y501-0658 |
| Compound Name: | 7-methyl-2-{5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-yl}-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 540.48 |
| Molecular Formula: | C24 H15 F3 N6 O4 S |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCc1ccc(c2nc3c4c(c5c(C)cc(C(F)(F)F)nc5s4)ncn3n2)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.4084 |
| logD: | 6.4049 |
| logSw: | -6.0978 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.37 |
| InChI Key: | MZBODNJSHLMMPL-UHFFFAOYSA-N |