2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-fluorobenzoate
Chemical Structure Depiction of
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-fluorobenzoate
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 6313-0012 |
| Compound Name: | 2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-fluorobenzoate |
| Molecular Weight: | 458.89 |
| Molecular Formula: | C22 H16 Cl F N2 O4 S |
| Smiles: | C(COC(c1ccc(cc1)F)=O)N(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0266 |
| logD: | 5.0266 |
| logSw: | -5.1687 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.859 |
| InChI Key: | QQCUNTUDGCZNBD-UHFFFAOYSA-N |