3-fluoro-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Chemical Structure Depiction of
3-fluoro-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
3-fluoro-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Compound characteristics
| Compound ID: | D336-3602 |
| Compound Name: | 3-fluoro-N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide |
| Molecular Weight: | 424.51 |
| Molecular Formula: | C22 H17 F N2 O2 S2 |
| Smiles: | C(CSc1nc2ccc(cc2s1)NC(c1cccc(c1)F)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7547 |
| logD: | 5.75 |
| logSw: | -5.8853 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.557 |
| InChI Key: | YDTKXAKATPNBMI-UHFFFAOYSA-N |