2-[3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-[3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C258-0402 |
| Compound Name: | 2-[3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 540.04 |
| Molecular Formula: | C27 H26 Cl N3 O5 S |
| Smiles: | COc1ccc(CCNC(CN2C(N(C(c3c4CCCc4sc23)=O)c2ccc(cc2)[Cl])=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5166 |
| logD: | 3.5166 |
| logSw: | -4.5048 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.967 |
| InChI Key: | SHZQZYWOZCVDQL-UHFFFAOYSA-N |