4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-bromobenzoate
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-bromobenzoate
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-bromobenzoate
Compound characteristics
| Compound ID: | 8007-3950 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-bromobenzoate |
| Molecular Weight: | 471.33 |
| Molecular Formula: | C21 H15 Br N2 O4 S |
| Smiles: | CN(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)OC(c1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7289 |
| logD: | 3.7289 |
| logSw: | -4.0908 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.229 |
| InChI Key: | TYESIISLFZPXPH-UHFFFAOYSA-N |