ethyl 4-{[(4-chlorophenyl)methyl]amino}-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(4-chlorophenyl)methyl]amino}-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
ethyl 4-{[(4-chlorophenyl)methyl]amino}-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K824-0075 |
| Compound Name: | ethyl 4-{[(4-chlorophenyl)methyl]amino}-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 433.91 |
| Molecular Formula: | C20 H20 Cl N3 O4 S |
| Smiles: | CCOC(c1c(C)c2c(NCc3ccc(cc3)[Cl])nc(CC(=O)OC)nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3456 |
| logD: | 4.3299 |
| logSw: | -4.5773 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.112 |
| InChI Key: | ZYSMPTUHBIMKRI-UHFFFAOYSA-N |