N-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
N-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D336-3840 |
| Compound Name: | N-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C21 H18 N2 O2 S3 |
| Smiles: | Cc1cccc(c1)OCCSc1nc2ccc(cc2s1)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0643 |
| logD: | 6.0643 |
| logSw: | -5.3763 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.576 |
| InChI Key: | BTTRTQDZQJQZTQ-UHFFFAOYSA-N |