N-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
N-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D336-4408 |
| Compound Name: | N-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide |
| Molecular Weight: | 446.99 |
| Molecular Formula: | C20 H15 Cl N2 O2 S3 |
| Smiles: | C(CSc1nc2ccc(cc2s1)NC(c1cccs1)=O)Oc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9038 |
| logD: | 5.9038 |
| logSw: | -6.1076 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.662 |
| InChI Key: | QQOUGIUUEPIZCK-UHFFFAOYSA-N |