3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl 4-(morpholine-4-sulfonyl)benzoate
Chemical Structure Depiction of
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl 4-(morpholine-4-sulfonyl)benzoate
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl 4-(morpholine-4-sulfonyl)benzoate
Compound characteristics
| Compound ID: | 6134-2990 |
| Compound Name: | 3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl 4-(morpholine-4-sulfonyl)benzoate |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C21 H23 N3 O7 S2 |
| Smiles: | C(CNC1c2ccccc2S(N=1)(=O)=O)COC(c1ccc(cc1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.753 |
| logD: | 1.753 |
| logSw: | -2.7172 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.675 |
| InChI Key: | WXAUMZMWOMACTO-UHFFFAOYSA-N |