2-({4-oxo-3-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-({4-oxo-3-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
2-({4-oxo-3-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | K263-0543 |
| Compound Name: | 2-({4-oxo-3-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 506.69 |
| Molecular Formula: | C27 H30 N4 O2 S2 |
| Smiles: | C1CCN(C1)CCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9137 |
| logD: | 1.7149 |
| logSw: | -4.0809 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.906 |
| InChI Key: | XTYKTZLWMLIAOP-UHFFFAOYSA-N |