2-(2-methylphenoxy)-N-(2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Chemical Structure Depiction of
2-(2-methylphenoxy)-N-(2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
2-(2-methylphenoxy)-N-(2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Compound characteristics
| Compound ID: | D336-1376 |
| Compound Name: | 2-(2-methylphenoxy)-N-(2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide |
| Molecular Weight: | 469.62 |
| Molecular Formula: | C24 H27 N3 O3 S2 |
| Smiles: | CC1CCN(CC1)C(CSc1nc2ccc(cc2s1)NC(COc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2418 |
| logD: | 5.2418 |
| logSw: | -5.0206 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.904 |
| InChI Key: | IIMOEELIIBFADH-UHFFFAOYSA-N |