ethyl {[6-(4-chlorobenzamido)-1,3-benzothiazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[6-(4-chlorobenzamido)-1,3-benzothiazol-2-yl]sulfanyl}acetate
ethyl {[6-(4-chlorobenzamido)-1,3-benzothiazol-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D336-5968 |
| Compound Name: | ethyl {[6-(4-chlorobenzamido)-1,3-benzothiazol-2-yl]sulfanyl}acetate |
| Molecular Weight: | 406.91 |
| Molecular Formula: | C18 H15 Cl N2 O3 S2 |
| Smiles: | CCOC(CSc1nc2ccc(cc2s1)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9455 |
| logD: | 4.9403 |
| logSw: | -5.0145 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.57 |
| InChI Key: | TZCHQSWUWMRNOH-UHFFFAOYSA-N |