ethyl 1-(2-amino-2-oxoethyl)-3-benzyl-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-benzyl-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-benzyl-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: | C694-0163 |
| Compound Name: | ethyl 1-(2-amino-2-oxoethyl)-3-benzyl-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | CCOC(N1CCc2c3C(N(Cc4ccccc4)C(N(CC(N)=O)c3sc2C1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2206 |
| logD: | 2.2206 |
| logSw: | -2.4569 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.012 |
| InChI Key: | LWFUOZFUNJLZFH-UHFFFAOYSA-N |