methyl 4-{2-[7-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[7-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
methyl 4-{2-[7-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L114-0352 |
| Compound Name: | methyl 4-{2-[7-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C23 H19 N3 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(CN1C=Nc2c(csc2C1=O)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8252 |
| logD: | 3.8252 |
| logSw: | -4.0951 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.701 |
| InChI Key: | TXLRJPDMNPWAFT-UHFFFAOYSA-N |