2-(4-{1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-(4-{1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-(2-phenylethyl)acetamide
2-(4-{1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | C241-1942 |
| Compound Name: | 2-(4-{1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 553.64 |
| Molecular Formula: | C31 H27 N3 O5 S |
| Smiles: | COc1ccc(C=O)cc1CN1C(N(C(c2c1ccs2)=O)c1ccc(CC(NCCc2ccccc2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4933 |
| logD: | 3.4933 |
| logSw: | -3.8136 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.505 |
| InChI Key: | LNUWZYDWNLRLJS-UHFFFAOYSA-N |