3-{[3-(4-ethylphenyl)-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-(4-ethylphenyl)-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-(4-ethylphenyl)-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: | C258-0486 |
| Compound Name: | 3-{[3-(4-ethylphenyl)-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: | 460.55 |
| Molecular Formula: | C26 H24 N2 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCCc3sc2N(Cc2cc(C=O)ccc2OC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0031 |
| logD: | 5.0031 |
| logSw: | -4.783 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.183 |
| InChI Key: | YDUHHVJIFMOXTP-UHFFFAOYSA-N |