ethyl 4-(2-bromo-4-methylanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-bromo-4-methylanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
ethyl 4-(2-bromo-4-methylanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K824-0022 |
| Compound Name: | ethyl 4-(2-bromo-4-methylanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 478.36 |
| Molecular Formula: | C20 H20 Br N3 O4 S |
| Smiles: | CCOC(c1c(C)c2c(Nc3ccc(C)cc3[Br])nc(CC(=O)OC)nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2794 |
| logD: | 5.2768 |
| logSw: | -5.3133 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.092 |
| InChI Key: | WNZWBHPKKFYFAK-UHFFFAOYSA-N |