2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-[(2,4-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-[(2,4-dimethoxyphenyl)methyl]acetamide
2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-[(2,4-dimethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | E848-1058 |
| Compound Name: | 2-[5-(azepane-1-sulfonyl)-1H-indol-1-yl]-N-[(2,4-dimethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C25 H31 N3 O5 S |
| Smiles: | COc1ccc(CNC(Cn2ccc3cc(ccc23)S(N2CCCCCC2)(=O)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9271 |
| logD: | 3.9271 |
| logSw: | -3.9482 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.765 |
| InChI Key: | TZOWXKSKWZELHC-UHFFFAOYSA-N |