ethyl 3-[5-(azepane-1-sulfonyl)-2-chlorobenzamido]benzoate
Chemical Structure Depiction of
ethyl 3-[5-(azepane-1-sulfonyl)-2-chlorobenzamido]benzoate
ethyl 3-[5-(azepane-1-sulfonyl)-2-chlorobenzamido]benzoate
Compound characteristics
| Compound ID: | L586-0913 |
| Compound Name: | ethyl 3-[5-(azepane-1-sulfonyl)-2-chlorobenzamido]benzoate |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C22 H25 Cl N2 O5 S |
| Smiles: | CCOC(c1cccc(c1)NC(c1cc(ccc1[Cl])S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.173 |
| logD: | 5.1632 |
| logSw: | -5.4473 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.125 |
| InChI Key: | BVCABIXJKOHKFP-UHFFFAOYSA-N |