3-{[3-(4-chlorophenyl)-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-chlorophenyl)-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-chlorophenyl)-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: | C258-0422 |
| Compound Name: | 3-{[3-(4-chlorophenyl)-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: | 466.94 |
| Molecular Formula: | C24 H19 Cl N2 O4 S |
| Smiles: | COc1ccc(C=O)cc1CN1C(N(C(c2c3CCCc3sc12)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6672 |
| logD: | 4.6672 |
| logSw: | -5.2306 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.183 |
| InChI Key: | GJFMBTKHIQYHJL-UHFFFAOYSA-N |