2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N,N-diethylacetamide
Chemical Structure Depiction of
2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N,N-diethylacetamide
2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N,N-diethylacetamide
Compound characteristics
| Compound ID: | E587-0455 |
| Compound Name: | 2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N,N-diethylacetamide |
| Molecular Weight: | 401.57 |
| Molecular Formula: | C22 H31 N3 O2 S |
| Smiles: | CCN(CC)C(CSc1cn(CC(N2CCCCCC2)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1733 |
| logD: | 3.1733 |
| logSw: | -2.955 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.099 |
| InChI Key: | GAKWJWFUKXSJFQ-UHFFFAOYSA-N |