N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Chemical Structure Depiction of
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Compound characteristics
| Compound ID: | D336-3552 |
| Compound Name: | N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C22 H18 N2 O2 S2 |
| Smiles: | C(CSc1nc2ccc(cc2s1)NC(c1ccccc1)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5269 |
| logD: | 5.5263 |
| logSw: | -5.7765 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.557 |
| InChI Key: | OPZBNURCTNXAPE-UHFFFAOYSA-N |