methyl 2-{4-[(2,6-dimethylphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-{4-[(2,6-dimethylphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-{4-[(2,6-dimethylphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y503-1481 |
| Compound Name: | methyl 2-{4-[(2,6-dimethylphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C25 H22 N4 O3 S |
| Smiles: | Cc1cccc(C)c1OCc1ccc(cc1)c1nc2c3c(C)c(C(=O)OC)sc3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.909 |
| logD: | 5.9049 |
| logSw: | -5.8942 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.694 |
| InChI Key: | VVBWQNNINBISII-UHFFFAOYSA-N |