2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | K263-0602 |
| Compound Name: | 2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 552.72 |
| Molecular Formula: | C31 H28 N4 O2 S2 |
| Smiles: | CC(C)c1ccc(cc1)NC(CSC1=Nc2c3ccccc3sc2C(N1CCc1c[nH]c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0759 |
| logD: | 7.0759 |
| logSw: | -5.9244 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.264 |
| InChI Key: | ITNXPOJTEHFPOD-UHFFFAOYSA-N |