ethyl 3-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)amino]benzoate
ethyl 3-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | F818-0837 |
| Compound Name: | ethyl 3-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)amino]benzoate |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C18 H18 N2 O5 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(Nc1cccc(c1)C(=O)OCC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.425 |
| logD: | 4.4165 |
| logSw: | -4.2218 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.211 |
| InChI Key: | ZRQAVZASFDQXIX-UHFFFAOYSA-N |