ethyl 3-(4-ethylphenyl)-1-[2-(3-methylanilino)-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-ethylphenyl)-1-[2-(3-methylanilino)-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-ethylphenyl)-1-[2-(3-methylanilino)-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: | C694-0109 |
| Compound Name: | ethyl 3-(4-ethylphenyl)-1-[2-(3-methylanilino)-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: | 546.65 |
| Molecular Formula: | C29 H30 N4 O5 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCN(Cc3sc2N(CC(Nc2cccc(C)c2)=O)C1=O)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1669 |
| logD: | 5.1669 |
| logSw: | -5.0295 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.891 |
| InChI Key: | OUBJLWFMHKCLMN-UHFFFAOYSA-N |