4-methoxy-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Chemical Structure Depiction of
4-methoxy-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
4-methoxy-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Compound characteristics
| Compound ID: | D336-3592 |
| Compound Name: | 4-methoxy-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C23 H20 N2 O3 S2 |
| Smiles: | COc1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCCOc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6143 |
| logD: | 5.614 |
| logSw: | -5.4535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.101 |
| InChI Key: | KILUXYQVTIVFHK-UHFFFAOYSA-N |