ethyl [(4-oxo-3-{4-oxo-4-[(2-phenylethyl)amino]butyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(4-oxo-3-{4-oxo-4-[(2-phenylethyl)amino]butyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
ethyl [(4-oxo-3-{4-oxo-4-[(2-phenylethyl)amino]butyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | K292-1289 |
| Compound Name: | ethyl [(4-oxo-3-{4-oxo-4-[(2-phenylethyl)amino]butyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CCOC(CSC1=Nc2ccsc2C(N1CCCC(NCCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.262 |
| logD: | 2.262 |
| logSw: | -2.5842 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.511 |
| InChI Key: | PGGSACPTYAEQED-UHFFFAOYSA-N |