N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide
Chemical Structure Depiction of
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | D336-4632 |
| Compound Name: | N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide |
| Molecular Weight: | 430.59 |
| Molecular Formula: | C22 H26 N2 O3 S2 |
| Smiles: | Cc1ccc(c(c1)OC)OCCSc1nc2ccc(cc2s1)NC(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2788 |
| logD: | 5.2788 |
| logSw: | -5.1273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.546 |
| InChI Key: | GKUOPARJDFDMCR-UHFFFAOYSA-N |