methyl 2-[2-(5,6-dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(5,6-dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
methyl 2-[2-(5,6-dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | C200-0920 |
| Compound Name: | methyl 2-[2-(5,6-dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C24 H21 N3 O5 S |
| Smiles: | Cc1c2C(N(C(N(CC(Nc3ccccc3C(=O)OC)=O)c2sc1C)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.608 |
| logD: | 3.5996 |
| logSw: | -3.9274 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.732 |
| InChI Key: | DFBLGJAZDQWTPR-UHFFFAOYSA-N |