2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | E848-1063 |
| Compound Name: | 2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 471.64 |
| Molecular Formula: | C24 H29 N3 O3 S2 |
| Smiles: | CSc1ccc(CNC(Cn2ccc3cc(ccc23)S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4268 |
| logD: | 4.4268 |
| logSw: | -4.2005 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.591 |
| InChI Key: | DIMLDLHJMOPOMI-UHFFFAOYSA-N |