ethyl 3-(4-chlorophenyl)-1-[2-(diethylamino)-2-oxoethyl]-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Chemical Structure Depiction of
ethyl 3-(4-chlorophenyl)-1-[2-(diethylamino)-2-oxoethyl]-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
ethyl 3-(4-chlorophenyl)-1-[2-(diethylamino)-2-oxoethyl]-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Compound characteristics
| Compound ID: | C694-0054 |
| Compound Name: | ethyl 3-(4-chlorophenyl)-1-[2-(diethylamino)-2-oxoethyl]-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
| Molecular Weight: | 519.02 |
| Molecular Formula: | C24 H27 Cl N4 O5 S |
| Smiles: | CCN(CC)C(CN1C(N(C(c2c3CCN(Cc3sc12)C(=O)OCC)=O)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2799 |
| logD: | 3.2799 |
| logSw: | -4.0609 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.417 |
| InChI Key: | BKQLMZALXXTZRK-UHFFFAOYSA-N |