8,9-dimethyl-2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
8,9-dimethyl-2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
8,9-dimethyl-2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-7088 |
| Compound Name: | 8,9-dimethyl-2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C20 H15 N5 O4 S |
| Smiles: | Cc1c2c3nc(c4ccc(COc5ccc(cc5)[N+]([O-])=O)o4)nn3cnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.6539 |
| logD: | 4.6497 |
| logSw: | -4.6671 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.57 |
| InChI Key: | SNHGBRKKVXFVPU-UHFFFAOYSA-N |