N-{2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl}-3-nitrobenzamide
N-{2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8010-0489 |
| Compound Name: | N-{2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl}-3-nitrobenzamide |
| Molecular Weight: | 374.37 |
| Molecular Formula: | C16 H14 N4 O5 S |
| Smiles: | C(CNC(c1cccc(c1)[N+]([O-])=O)=O)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8182 |
| logD: | 0.8182 |
| logSw: | -2.506 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.916 |
| InChI Key: | OLDGKIYXDLEKNW-UHFFFAOYSA-N |