3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl chloroacetate
Chemical Structure Depiction of
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl chloroacetate
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl chloroacetate
Compound characteristics
| Compound ID: | 4418-0028 |
| Compound Name: | 3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl chloroacetate |
| Molecular Weight: | 350.78 |
| Molecular Formula: | C15 H11 Cl N2 O4 S |
| Smiles: | C(C(=O)Oc1cccc(c1)NC1c2ccccc2S(N=1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1515 |
| logD: | 2.1394 |
| logSw: | -3.1017 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.899 |
| InChI Key: | BLODBORCWWDPBJ-UHFFFAOYSA-N |