2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl thiophene-2-carboxylate
Chemical Structure Depiction of
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl thiophene-2-carboxylate
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 6681-0033 |
| Compound Name: | 2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl thiophene-2-carboxylate |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C20 H15 Cl N2 O4 S2 |
| Smiles: | C(COC(c1cccs1)=O)N(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5606 |
| logD: | 4.5606 |
| logSw: | -4.8866 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.878 |
| InChI Key: | NIJHDHMOMUVPNZ-UHFFFAOYSA-N |