3-(3-methoxybenzamido)phenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
Chemical Structure Depiction of
3-(3-methoxybenzamido)phenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
3-(3-methoxybenzamido)phenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
Compound characteristics
| Compound ID: | 8008-4110 |
| Compound Name: | 3-(3-methoxybenzamido)phenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate |
| Molecular Weight: | 543.04 |
| Molecular Formula: | C27 H27 Cl N2 O6 S |
| Smiles: | COc1cccc(c1)C(Nc1cccc(c1)OC(c1cc(ccc1[Cl])S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7817 |
| logD: | 5.7815 |
| logSw: | -5.9177 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.293 |
| InChI Key: | AGTURAOZYTWMJQ-UHFFFAOYSA-N |