N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D336-3556 |
| Compound Name: | N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C20 H16 N2 O2 S3 |
| Smiles: | C(CSc1nc2ccc(cc2s1)NC(c1cccs1)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5445 |
| logD: | 5.5445 |
| logSw: | -5.7454 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.576 |
| InChI Key: | OJZOLNFTOPTHBU-UHFFFAOYSA-N |