N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-ethylacetamide
Chemical Structure Depiction of
N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-ethylacetamide
N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-ethylacetamide
Compound characteristics
Compound ID: | C258-0491 |
Compound Name: | N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-ethylacetamide |
Molecular Weight: | 519.62 |
Molecular Formula: | C28 H29 N3 O5 S |
Smiles: | CCN(Cc1ccccc1)C(CN1C(N(C(c2c3CCCc3sc12)=O)c1ccc(cc1OC)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1546 |
logD: | 4.1546 |
logSw: | -4.4051 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 61.947 |
InChI Key: | BEUKLDJJAKVOSF-UHFFFAOYSA-N |