N-[2-(1H-indol-3-yl)ethyl]-2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
N-[2-(1H-indol-3-yl)ethyl]-2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y042-4572 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C20 H20 N4 O2 S2 |
| Smiles: | Cc1cc2C(NC(CSCC(NCCc3c[nH]c4ccccc34)=O)=Nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.877 |
| logD: | 2.8766 |
| logSw: | -3.3675 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.987 |
| InChI Key: | BZOUVFODRNIBEA-UHFFFAOYSA-N |