methyl 2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-2068 |
| Compound Name: | methyl 2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C23 H20 N4 O4 S |
| Smiles: | Cc1ccc(C)c(c1)OCc1ccc(c2nc3c4c(C)c(C(=O)OC)sc4ncn3n2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.2498 |
| logD: | 5.2462 |
| logSw: | -5.2662 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.449 |
| InChI Key: | WPKKQPZDEIVJOQ-UHFFFAOYSA-N |