2-methyl-N-(2-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
2-methyl-N-(2-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
2-methyl-N-(2-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | D336-4061 |
| Compound Name: | 2-methyl-N-(2-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 386.53 |
| Molecular Formula: | C20 H22 N2 O2 S2 |
| Smiles: | CC(C)C(Nc1ccc2c(c1)sc(n2)SCCOc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4116 |
| logD: | 5.4115 |
| logSw: | -5.2875 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.916 |
| InChI Key: | BIFHERIUUYLJJA-UHFFFAOYSA-N |