ethyl 4-[2-({3-[2-(2-bromophenoxy)acetamido]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-({3-[2-(2-bromophenoxy)acetamido]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamido]benzoate
ethyl 4-[2-({3-[2-(2-bromophenoxy)acetamido]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamido]benzoate
Compound characteristics
| Compound ID: | K292-1897 |
| Compound Name: | ethyl 4-[2-({3-[2-(2-bromophenoxy)acetamido]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamido]benzoate |
| Molecular Weight: | 645.55 |
| Molecular Formula: | C27 H25 Br N4 O6 S2 |
| Smiles: | CCC(C(Nc1ccc(cc1)C(=O)OCC)=O)SC1=Nc2ccsc2C(N1NC(COc1ccccc1[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3811 |
| logD: | 5.3809 |
| logSw: | -5.4678 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.679 |
| InChI Key: | VVCQBDSZQMMMKQ-NRFANRHFSA-N |