3-benzamidophenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
Chemical Structure Depiction of
3-benzamidophenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
3-benzamidophenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate
Compound characteristics
| Compound ID: | 3019-0108 |
| Compound Name: | 3-benzamidophenyl 5-(azepane-1-sulfonyl)-2-chlorobenzoate |
| Molecular Weight: | 513.01 |
| Molecular Formula: | C26 H25 Cl N2 O5 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(c(c1)C(=O)Oc1cccc(c1)NC(c1ccccc1)=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6144 |
| logD: | 5.6136 |
| logSw: | -5.918 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.749 |
| InChI Key: | LGAPDKHGKPGNKD-UHFFFAOYSA-N |