2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl pyridine-4-carboxylate
Chemical Structure Depiction of
2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl pyridine-4-carboxylate
2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl pyridine-4-carboxylate
Compound characteristics
| Compound ID: | 5306-0326 |
| Compound Name: | 2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl pyridine-4-carboxylate |
| Molecular Weight: | 441.89 |
| Molecular Formula: | C21 H16 Cl N3 O4 S |
| Smiles: | C(COC(c1ccncc1)=O)N(C1c2ccccc2S(N=1)(=O)=O)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5599 |
| logD: | 3.5593 |
| logSw: | -4.031 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.987 |
| InChI Key: | LZEQLCFQKAWLOE-UHFFFAOYSA-N |