2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-(piperidine-1-sulfonyl)benzoate
Chemical Structure Depiction of
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-(piperidine-1-sulfonyl)benzoate
2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-(piperidine-1-sulfonyl)benzoate
Compound characteristics
| Compound ID: | 5941-1340 |
| Compound Name: | 2-[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 4-(piperidine-1-sulfonyl)benzoate |
| Molecular Weight: | 588.1 |
| Molecular Formula: | C27 H26 Cl N3 O6 S2 |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)C(=O)OCCN(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0948 |
| logD: | 5.0948 |
| logSw: | -5.3337 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 94.57 |
| InChI Key: | LKODHARCOMLXHE-UHFFFAOYSA-N |