methyl 2-[2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
methyl 2-[2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | C200-1074 |
| Compound Name: | methyl 2-[2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamido]benzoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C25 H23 N3 O5 S |
| Smiles: | Cc1c2C(N(Cc3ccccc3)C(N(CC(Nc3ccccc3C(=O)OC)=O)c2sc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4297 |
| logD: | 4.4193 |
| logSw: | -4.4999 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.344 |
| InChI Key: | ARJKRPJGAGGUSD-UHFFFAOYSA-N |