3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl chloro(phenyl)acetate
Chemical Structure Depiction of
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl chloro(phenyl)acetate
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl chloro(phenyl)acetate
Compound characteristics
| Compound ID: | 3971-1742 |
| Compound Name: | 3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl chloro(phenyl)acetate |
| Molecular Weight: | 392.86 |
| Molecular Formula: | C18 H17 Cl N2 O4 S |
| Smiles: | C(CNC1c2ccccc2S(N=1)(=O)=O)COC(C(c1ccccc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8155 |
| logD: | 2.8154 |
| logSw: | -3.6247 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.056 |
| InChI Key: | ZYKGVPQTTVISKW-MRXNPFEDSA-N |