ethyl 2-[2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 2-[2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)acetamido]benzoate
ethyl 2-[2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | E587-0532 |
| Compound Name: | ethyl 2-[2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 493.62 |
| Molecular Formula: | C27 H31 N3 O4 S |
| Smiles: | CCOC(c1ccccc1NC(CSc1cn(CC(N2CCC(C)CC2)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1326 |
| logD: | 4.114 |
| logSw: | -3.8435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.297 |
| InChI Key: | HYSHDTMKZFCHCW-UHFFFAOYSA-N |