3-{[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]methyl}-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-{[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]methyl}-4-methoxybenzaldehyde
3-{[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]methyl}-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | C258-0493 |
| Compound Name: | 3-{[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]methyl}-4-methoxybenzaldehyde |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C26 H24 N2 O6 S |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2c3CCCc3sc2N(Cc2cc(C=O)ccc2OC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2755 |
| logD: | 4.2755 |
| logSw: | -4.5882 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.057 |
| InChI Key: | CMMSTZPBZMDOIL-UHFFFAOYSA-N |