ethyl 1-(2-amino-2-oxoethyl)-3-(4-chlorophenyl)-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 1-(2-amino-2-oxoethyl)-3-(4-chlorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
ethyl 1-(2-amino-2-oxoethyl)-3-(4-chlorophenyl)-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: | C694-0073 |
| Compound Name: | ethyl 1-(2-amino-2-oxoethyl)-3-(4-chlorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
| Molecular Weight: | 462.91 |
| Molecular Formula: | C20 H19 Cl N4 O5 S |
| Smiles: | CCOC(N1CCc2c3C(N(C(N(CC(N)=O)c3sc2C1)=O)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1152 |
| logD: | 2.1152 |
| logSw: | -3.185 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.401 |
| InChI Key: | GRQDKJFSUVLQIY-UHFFFAOYSA-N |