methyl 2-{4-[(4-ethoxyphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-{4-[(4-ethoxyphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-{4-[(4-ethoxyphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-3054 |
| Compound Name: | methyl 2-{4-[(4-ethoxyphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 474.54 |
| Molecular Formula: | C25 H22 N4 O4 S |
| Smiles: | CCOc1ccc(cc1)OCc1ccc(cc1)c1nc2c3c(C)c(C(=O)OC)sc3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3186 |
| logD: | 5.3145 |
| logSw: | -5.5191 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.644 |
| InChI Key: | BQSRARSLRJKKNI-UHFFFAOYSA-N |