ethyl 4-(3-chloro-4-fluoroanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-chloro-4-fluoroanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
ethyl 4-(3-chloro-4-fluoroanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K824-0032 |
| Compound Name: | ethyl 4-(3-chloro-4-fluoroanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 437.88 |
| Molecular Formula: | C19 H17 Cl F N3 O4 S |
| Smiles: | CCOC(c1c(C)c2c(Nc3ccc(c(c3)[Cl])F)nc(CC(=O)OC)nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9113 |
| logD: | 4.9087 |
| logSw: | -5.0058 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.79 |
| InChI Key: | VJYAQJRHHAVCNU-UHFFFAOYSA-N |